Chemical compounds for High-Throughput screening and
Building Blocks for Combinatorial chemistry

FULL DB

Total number of items: 1540439
Total number of pages: 1541 ( 1000 items on each page )

Direct access:
1, 2, 3, 4, 5, 6, 7, 8, 9, 10, 11, 12, 13, 14, 15, 16, 17, 18, 19, 20, 21, 22, 23, 24, 25, 26, 27, 28, 29, 30, 31, 32, 33, 34, 35, 36, 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 61, 62, 63, 64, 65, 66, 67, 68, 69, 70, 71, 72, 73, 74, 75, 76, 77, 78, 79, 80, 81, 82, 83, 84, 85, 86, 87, 88, 89, 90, 91, 92, 93, 94, 95, 96, 97, 98, 99, 100, 101, 102, 103, 104, 105, 106, 107, 108, 109, 110, 111, 112, 113, 114, 115, 116, 117, 118, 119, 120, 121, 122, 123, 124, 125, 126, 127, 128, 129, 130, 131, 132, 133, 134, 135, 136, 137, 138, 139, 140, 141, 142, 143, 144, 145, 146, 147, 148, 149, 150, 151, 152, 153, 154, 155, 156, 157, 158, 159, 160, 161, 162, 163, 164, 165, 166, 167, 168, 169, 170, 171, 172, 173, 174, 175, 176, 177, 178, 179, 180, 181, 182, 183, 184, 185, 186, 187, 188, 189, 190, 191, 192, 193, 194, 195, 196, 197, 198, 199, 200, 201, 202, 203, 204, 205, 206, 207, 208, 209, 210, 211, 212, 213, 214, 215, 216, 217, 218, 219, 220, 221, 222, 223, 224, 225, 226, 227, 228, 229, 230, 231, 232, 233, 234, 235, 236, 237, 238, 239, 240, 241, 242, 243, 244, 245, 246, 247, 248, 249, 250, 251, 252, 253, 254, 255, 256, 257, 258, 259, 260, 261, 262, 263, 264, 265, 266, 267, 268, 269, 270, 271, 272, 273, 274, 275, 276, 277, 278, 279, 280, 281, 282, 283, 284, 285, 286, 287, 288, 289, 290, 291, 292, 293, 294, 295, 296, 297, 298, 299, 300, 301, 302, 303, 304, 305, 306, 307, 308, 309, 310, 311, 312, 313, 314, 315, 316, 317, 318, 319, 320, 321, 322, 323, 324, 325, 326, 327, 328, 329, 330, 331, 332, 333, 334, 335, 336, 337, 338, 339, 340, 341, 342, 343, 344, 345, 346, 347, 348, 349, 350, 351, 352, 353, 354, 355, 356, 357, 358, 359, 360, 361, 362, 363, 364, 365, 366, 367, 368, 369, 370, 371, 372, 373, 374, 375, 376, 377, 378, 379, 380, 381, 382, 383, 384, 385, 386, 387, 388, 389, 390, 391, 392, 393, 394, 395, 396, 397, 398, 399, 400, 401, 402, 403, 404, 405, 406, 407, 408, 409, 410, 411, 412, 413, 414, 415, 416, 417, 418, 419, 420, 421, 422, 423, 424, 425, 426, 427, 428, 429, 430, 431, 432, 433, 434, 435, 436, 437, 438, 439, 440, 441, 442, 443, 444, 445, 446, 447, 448, 449, 450, 451, 452, 453, 454, 455, 456, 457, 458, 459, 460, 461, 462, 463, 464, 465, 466, 467, 468, 469, 470, 471, 472, 473, 474, 475, 476, 477, 478, 479, 480, 481, 482, 483, 484, 485, 486, 487, 488, 489, 490, 491, 492, 493, 494, 495, 496, 497, 498, 499, 500, 501, 502, 503, 504, 505, 506, 507, 508, 509, 510, 511, 512, 513, 514, 515, 516, 517, 518, 519, 520, 521, 522, 523, 524, 525, 526, 527, 528, 529, 530, 531, 532, 533, 534, 535, 536, 537, 538, 539, 540, 541, 542, 543, 544, 545, 546, 547, 548, 549, 550, 551, 552, 553, 554, 555, 556, 557, 558, 559, 560, 561, 562, 563, 564, 565, 566, 567, 568, 569, 570, 571, 572, 573, 574, 575, 576, 577, 578, 579, 580, 581, 582, 583, 584, 585, 586, 587, 588, 589, 590, 591, 592, 593, 594, 595, 596, 597, 598, 599, 600, 601, 602, 603, 604, 605, 606, 607, 608, 609, 610, 611, 612, 613, 614, 615, 616, 617, 618, 619, 620, 621, 622, 623, 624, 625, 626, 627, 628, 629, 630, 631, 632, 633, 634, 635, 636, 637, 638, 639, 640, 641, 642, 643, 644, 645, 646, 647, 648, 649, 650, 651, 652, 653, 654, 655, 656, 657, 658, 659, 660, 661, 662, 663, 664, 665, 666, 667, 668, 669, 670, 671, 672, 673, 674, 675, 676, 677, 678, 679, 680, 681, 682, 683, 684, 685, 686, 687, 688, 689, 690, 691, 692, 693, 694, 695, 696, 697, 698, 699, 700, 701, 702, 703, 704, 705, 706, 707, 708, 709, 710, 711, 712, 713, 714, 715, 716, 717, 718, 719, 720, 721, 722, 723, 724, 725, 726, 727, 728, 729, 730, 731, 732, 733, 734, 735, 736, 737, 738, 739, 740, 741, 742, 743, 744, 745, 746, 747, 748, 749, 750, 751, 752, 753, 754, 755, 756, 757, 758, 759, 760, 761, 762, 763, 764, 765, 766, 767, 768, 769, 770, 771, 772, 773, 774, 775, 776, 777, 778, 779, 780, 781, 782, 783, 784, 785, 786, 787, 788, 789, 790, 791, 792, 793, 794, 795, 796, 797, 798, 799, 800, 801, 802, 803, 804, 805, 806, 807, 808, 809, 810, 811, 812, 813, 814, 815, 816, 817, 818, 819, 820, 821, 822, 823, 824, 825, 826, 827, 828, 829, 830, 831, 832, 833, 834, 835, 836, 837, 838, 839, 840, 841, 842, 843, 844, 845, 846, 847, 848, 849, 850, 851, 852, 853, 854, 855, 856, 857, 858, 859, 860, 861, 862, 863, 864, 865, 866, 867, 868, 869, 870, 871, 872, 873, 874, 875, 876, 877, 878, 879, 880, 881, 882, 883, 884, 885, 886, 887, 888, 889, 890, 891, 892, 893, 894, 895, 896, 897, 898, 899, 900, 901, 902, 903, 904, 905, 906, 907, 908, 909, 910, 911, 912, 913, 914, 915, 916, 917, 918, 919, 920, 921, 922, 923, 924, 925, 926, 927, 928, 929, 930, 931, 932, 933, 934, 935, 936, 937 938, 939, 940, 941, 942, 943, 944, 945, 946, 947, 948, 949, 950, 951, 952, 953, 954, 955, 956, 957, 958, 959, 960, 961, 962, 963, 964, 965, 966, 967, 968, 969, 970, 971, 972, 973, 974, 975, 976, 977, 978, 979, 980, 981, 982, 983, 984, 985, 986, 987, 988, 989, 990, 991, 992, 993, 994, 995, 996, 997, 998, 999, 1000, 1001, 1002, 1003, 1004, 1005, 1006, 1007, 1008, 1009, 1010, 1011, 1012, 1013, 1014, 1015, 1016, 1017, 1018, 1019, 1020, 1021, 1022, 1023, 1024, 1025, 1026, 1027, 1028, 1029, 1030, 1031, 1032, 1033, 1034, 1035, 1036, 1037, 1038, 1039, 1040, 1041, 1042, 1043, 1044, 1045, 1046, 1047, 1048, 1049, 1050, 1051, 1052, 1053, 1054, 1055, 1056, 1057, 1058, 1059, 1060, 1061, 1062, 1063, 1064, 1065, 1066, 1067, 1068, 1069, 1070, 1071, 1072, 1073, 1074, 1075, 1076, 1077, 1078, 1079, 1080, 1081, 1082, 1083, 1084, 1085, 1086, 1087, 1088, 1089, 1090, 1091, 1092, 1093, 1094, 1095, 1096, 1097, 1098, 1099, 1100, 1101, 1102, 1103, 1104, 1105, 1106, 1107, 1108, 1109, 1110, 1111, 1112, 1113, 1114, 1115, 1116, 1117, 1118, 1119, 1120, 1121, 1122, 1123, 1124, 1125, 1126, 1127, 1128, 1129, 1130, 1131, 1132, 1133, 1134, 1135, 1136, 1137, 1138, 1139, 1140, 1141, 1142, 1143, 1144, 1145, 1146, 1147, 1148, 1149, 1150, 1151, 1152, 1153, 1154, 1155, 1156, 1157, 1158, 1159, 1160, 1161, 1162, 1163, 1164, 1165, 1166, 1167, 1168, 1169, 1170, 1171, 1172, 1173, 1174, 1175, 1176, 1177, 1178, 1179, 1180, 1181, 1182, 1183, 1184, 1185, 1186, 1187, 1188, 1189, 1190, 1191, 1192, 1193, 1194, 1195, 1196, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1205, 1206, 1207, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1215, 1216, 1217, 1218, 1219, 1220, 1221, 1222, 1223, 1224, 1225, 1226, 1227, 1228, 1229, 1230, 1231, 1232, 1233, 1234, 1235, 1236, 1237, 1238, 1239, 1240, 1241, 1242, 1243, 1244, 1245, 1246, 1247, 1248, 1249, 1250, 1251, 1252, 1253, 1254, 1255, 1256, 1257, 1258, 1259, 1260, 1261, 1262, 1263, 1264, 1265, 1266, 1267, 1268, 1269, 1270, 1271, 1272, 1273, 1274, 1275, 1276, 1277, 1278, 1279, 1280, 1281, 1282, 1283, 1284, 1285, 1286, 1287, 1288, 1289, 1290, 1291, 1292, 1293, 1294, 1295, 1296, 1297, 1298, 1299, 1300, 1301, 1302, 1303, 1304, 1305, 1306, 1307, 1308, 1309, 1310, 1311, 1312, 1313, 1314, 1315, 1316, 1317, 1318, 1319, 1320, 1321, 1322, 1323, 1324, 1325, 1326, 1327, 1328, 1329, 1330, 1331, 1332, 1333, 1334, 1335, 1336, 1337, 1338, 1339, 1340, 1341, 1342, 1343, 1344, 1345, 1346, 1347, 1348, 1349, 1350, 1351, 1352, 1353, 1354, 1355, 1356, 1357, 1358, 1359, 1360, 1361, 1362, 1363, 1364, 1365, 1366, 1367, 1368, 1369, 1370, 1371, 1372, 1373, 1374, 1375, 1376, 1377, 1378, 1379, 1380, 1381, 1382, 1383, 1384, 1385, 1386, 1387, 1388, 1389, 1390, 1391, 1392, 1393, 1394, 1395, 1396, 1397, 1398, 1399, 1400, 1401, 1402, 1403, 1404, 1405, 1406, 1407, 1408, 1409, 1410, 1411, 1412, 1413, 1414, 1415, 1416, 1417, 1418, 1419, 1420, 1421, 1422, 1423, 1424, 1425, 1426, 1427, 1428, 1429, 1430, 1431, 1432, 1433, 1434, 1435, 1436, 1437, 1438, 1439, 1440, 1441, 1442, 1443, 1444, 1445, 1446, 1447, 1448, 1449, 1450, 1451, 1452, 1453, 1454, 1455, 1456, 1457, 1458, 1459, 1460, 1461, 1462, 1463, 1464, 1465, 1466, 1467, 1468, 1469, 1470, 1471, 1472, 1473, 1474, 1475, 1476, 1477, 1478, 1479, 1480, 1481, 1482, 1483, 1484, 1485, 1486, 1487, 1488, 1489, 1490, 1491, 1492, 1493, 1494, 1495, 1496, 1497, 1498, 1499, 1500, 1501, 1502, 1503, 1504, 1505, 1506, 1507, 1508, 1509, 1510, 1511, 1512, 1513, 1514, 1515, 1516, 1517, 1518, 1519, 1520, 1521, 1522, 1523, 1524, 1525, 1526, 1527, 1528, 1529, 1530, 1531, 1532, 1533, 1534, 1535, 1536, 1537, 1538, 1539, 1540, 1541,

Prev 930 931 932 933 934 935 936 937 938 939 Next

STK628963
Synonyms: 3- (2,4- dichlorophenyl)- N,N,2,5- tetramethylpyrazolo[1,5- a]pyrimidin- 7- amine
Smiles: Clc1ccc(c(c1)Cl)c1c(C)nn2c1nc(C)cc2N(C)C

STK628964
Synonyms: 4- methyl- 3- {2- [(5- methyl- 1,3- thiazol- 2- yl)amino]- 2- oxoethyl}- 2- oxo- 2H- chromen- 7- ylacetate
Smiles: O=C(Cc1c(=O)oc2c(c1C)ccc(c2)OC(=O)C)Nc1ncc(s1)C

STK628965
Synonyms: N- [2- hydroxy- 3- (2- hydroxy- 4,4- dimethyl- 5- oxo- 4,5- dihydro- 1H- imidazol- 1- yl)propyl]- N- (4- methoxyphenyl)- 4- methylbenzenesulfonamide
Smiles: COc1ccc(cc1)N(S(=O)(=O)c1ccc(cc1)C)CC(CN1C(=NC(C1=O)(C)C)O)O

STK628969
Synonyms: 3- (3- tert- butyl- 5- methyl- 7- oxo- 7H- furo[3,2- g]chromen- 6- yl)- N- (1,1- dioxidotetrahydrothiophen- 3- yl)- N- methylpropanamide
Smiles: O=C(N(C1CCS(=O)(=O)C1)C)CCc1c(=O)oc2c(c1C)cc1c(c2)occ1C(C)(C)C

STK628970
Synonyms: N- [(2Z)- 2- (acetylimino)- 4- phenyl- 2,3- dihydro- 1,3- thiazol- 5- yl]- 2- phenylacetamide
Smiles: CC(=O)/N=c\1/[nH]c(c(s1)NC(=O)Cc1ccccc1)c1ccccc1

STK857003
Synonyms: N- (4- chlorophenyl)- 3,4- dihydro- 1H- isochromene- 1- carboxamide
Smiles: O=C(C1OCCc2c1cccc2)Nc1ccc(cc1)Cl

STK628976
Synonyms: 3- [(4S)- 1- (1,3- benzodioxol- 5- ylmethyl)- 2,5- dioxoimidazolidin- 4- yl]- N- (2- methoxybenzyl)propanamide
Smiles: COc1ccccc1CNC(=O)CC[C@@H]1NC(=O)N(C1=O)Cc1ccc2c(c1)OCO2

STK628978
Synonyms: 1- (1H- indol- 2- ylcarbonyl)- N- (3- methoxyphenyl)piperidine- 3- carboxamide
Smiles: COc1cccc(c1)NC(=O)C1CCCN(C1)C(=O)c1cc2c([nH]1)cccc2

STK628979
Synonyms: 4- [(Z)- (3- methyl- 4- oxo- 2- thioxo- 1,3- thiazolidin- 5- ylidene)methyl]- N- (quinoxalin- 6- yl)benzamide
Smiles: S=C1S/C(=C\c2ccc(cc2)C(=O)Nc2ccc3c(c2)nccn3)/C(=O)N1C

STK628980
Synonyms: 2- benzyl- N- (2- methylpropyl)- 7,8- dihydro- 6H- thiopyrano[3,2- d]pyrimidin- 4- amine
Smiles: CC(CNc1nc(Cc2ccccc2)nc2c1SCCC2)C

STK628982
Synonyms: (5Z)- 3- benzyl- 5- (quinolin- 8- ylmethylidene)- 2- thioxo- 1,3- thiazolidin- 4- one
Smiles: S=C1S/C(=C\c2cccc3c2nccc3)/C(=O)N1Cc1ccccc1

STK628987
Synonyms: 5- (2- methoxyphenyl)- 2- (methylsulfanyl)[1,2,4]triazolo[1,5- a]pyrimidin- 7- ol
Smiles: COc1ccccc1c1cc(O)n2c(n1)nc(n2)SC

STK628988
Synonyms: (5E)- 3- (4- chlorophenyl)- 5- (quinoxalin- 2- ylmethylidene)- 2- thioxo- 1,3- thiazolidin- 4- one
Smiles: Clc1ccc(cc1)N1C(=S)S/C(=C/c2cnc3c(n2)cccc3)/C1=O

STK628990
Synonyms: 6- [2- (3,5- dimethyl- 1- phenyl- 1H- pyrazol- 4- yl)ethyl]- 3- (furan- 2- yl)[1,2,4]triazolo[3,4- b][1,3,4]thiadiazole
Smiles: Cc1nn(c(c1CCc1sc2n(n1)c(nn2)c1ccco1)C)c1ccccc1

STK628991
Synonyms: (2E)- 2- [(1- ethyl- 5- methoxy- 1H- indol- 3- yl)methylidene]- 7- methyl- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl2- chlorobenzoate
Smiles: COc1ccc2c(c1)c(/C=C\1/Oc3c(C1=O)ccc(c3C)OC(=O)c1ccccc1Cl)cn2CC

STK857005
Synonyms: (2Z)- 2- (2- chlorobenzylidene)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- ylfuran- 2- carboxylate
Smiles: O=C(c1ccco1)Oc1ccc2c(c1)O/C(=C\c1ccccc1Cl)/C2=O

STK628992
Synonyms: N~3~- (2- chloro- 7H- purin- 6- yl)- N- [2- (4- methoxyphenyl)ethyl]- beta- alaninamide
Smiles: COc1ccc(cc1)CCNC(=O)CCNc1nc(Cl)nc2c1[nH]cn2

STK628993
Synonyms: 6- (3- chloro- 4- fluorophenyl)- 3- (pyridin- 4- yl)[1,2,4]triazolo[3,4- b][1,3,4]thiadiazole
Smiles: Fc1ccc(cc1Cl)c1nn2c(s1)nnc2c1ccncc1

STK628997
Synonyms: (2Z)- 2- (2- methoxybenzylidene)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl4- chlorobenzenesulfonate
Smiles: COc1ccccc1/C=C/1\Oc2c(C1=O)ccc(c2)OS(=O)(=O)c1ccc(cc1)Cl

STK628998
Synonyms: 8,9- dimethyl- 7- phenyl- 7H- pyrrolo[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: Cc1c(C)n(c2c1c1ncnn1cn2)c1ccccc1

STK629000
Synonyms: 2- ethoxy- N- (pyridin- 3- ylmethyl)- N- [2- (pyrrolidin- 1- ylsulfonyl)ethyl]pyridine- 3- carboxamide
Smiles: CCOc1ncccc1C(=O)N(Cc1cccnc1)CCS(=O)(=O)N1CCCC1

STK629005
Synonyms: 6- {1- [4- (2- methylpropyl)phenyl]ethyl}- 3- (pyrazin- 2- yl)[1,2,4]triazolo[3,4- b][1,3,4]thiadiazole
Smiles: CC(Cc1ccc(cc1)C(c1nn2c(s1)nnc2c1cnccn1)C)C

STK629006
Synonyms: (2Z)- 8- (furan- 2- ylmethyl)- 2- (2,3,4- trimethoxybenzylidene)- 8,9- dihydro- 7H- furo[2,3- f][1,3]benzoxazin- 3(2H)- one
Smiles: COc1c(ccc(c1OC)OC)/C=C/1\Oc2c(C1=O)ccc1c2CN(CO1)Cc1ccco1

STK629008
Synonyms: (2E)- 2- [(5- methoxy- 1- methyl- 1H- indol- 3- yl)methylidene]- 7- methyl- 6- (2- oxopropoxy)- 1- benzofuran- 3(2H)- one
Smiles: COc1ccc2c(c1)c(/C=C\1/Oc3c(C1=O)ccc(c3C)OCC(=O)C)cn2C

STK629009
Synonyms: 5- amino- 2- (2- chlorophenyl)- 4- methylthieno[2,3- d]pyrimidine- 6- carboxamide
Smiles: Clc1ccccc1c1nc(C)c2c(n1)sc(c2N)C(=O)N

STK629012
Synonyms: 3- tert- butyl- 6- hydroxy- 9- methyl- 1,4- dihydro[1,2,4]triazino[3,4- f]purin- 8(9H)- one
Smiles: CC(C1=NNc2n(C1)c1c(O)nc(=O)n(c1n2)C)(C)C

STK629013
Synonyms: (2E)- 6- [(4- methoxybenzyl)oxy]- 7- methyl- 2- [(1- methyl- 1H- indol- 3- yl)methylidene]- 1- benzofuran- 3(2H)- one
Smiles: COc1ccc(cc1)COc1ccc2c(c1C)O/C(=C/c1cn(c3c1cccc3)C)/C2=O

STK629014
Synonyms: 3- amino- 6- (pyridin- 2- yl)thieno[2,3- b]pyridine- 2- carboxamide
Smiles: NC(=O)c1sc2c(c1N)ccc(n2)c1ccccn1

STK629015
Synonyms: 2- {2- [4- (pyridin- 3- yl)- 5- thioxo- 4,5- dihydro- 1H- 1,2,4- triazol- 3- yl]ethyl}phthalazin- 1(2H)- one
Smiles: S=c1[nH]nc(n1c1cccnc1)CCn1ncc2c(c1=O)cccc2

STK629018
Synonyms: N- [1- (2,4- dichlorobenzyl)- 3,5- dimethyl- 1H- pyrazol- 4- yl]- N'- (pyridin- 2- ylmethyl)ethanediamide
Smiles: Clc1ccc(c(c1)Cl)Cn1nc(c(c1C)NC(=O)C(=O)NCc1ccccn1)C

STK629025
Synonyms: 6- (5- bromopyridin- 3- yl)- 3- [(4- methoxyphenoxy)methyl][1,2,4]triazolo[3,4- b][1,3,4]thiadiazole
Smiles: COc1ccc(cc1)OCc1nnc2n1nc(s2)c1cncc(c1)Br

STK629028
Synonyms: 6- fluoro- 3- (piperidin- 4- yl)- 1,2- benzoxazole
Smiles: Fc1ccc2c(c1)onc2C1CCNCC1

STK629029
Synonyms: 2- (furan- 2- yl)- 10,10- dimethyl- 10,11- dihydro- 8H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 5- ol
Smiles: Oc1nc2sc3c(c2c2n1nc(n2)c1ccco1)CC(OC3)(C)C

STK629031
Synonyms: 4- (2,3- dihydro- 1,4- benzodioxin- 6- ylsulfonyl)- 2- (furan- 2- yl)- N- (prop- 2- en- 1- yl)- 1,3- oxazol- 5- amine
Smiles: C=CCNc1oc(nc1S(=O)(=O)c1ccc2c(c1)OCCO2)c1ccco1

STK857006
Synonyms: 1- (2,4- dihydroxyphenyl)- 2- (2- methoxyphenyl)ethanone
Smiles: COc1ccccc1CC(=O)c1ccc(cc1O)O

STK629032
Synonyms: 3- (2- methoxyphenyl)- 2- methyl- 9- (3- phenylpropyl)- 9,10- dihydro- 4H,8H- chromeno[8,7- e][1,3]oxazin- 4- one
Smiles: COc1ccccc1c1c(C)oc2c(c1=O)ccc1c2CN(CCCc2ccccc2)CO1

STK629035
Synonyms: [4- (1,3- benzodioxol- 5- ylmethyl)piperazin- 1- yl][1- (2- chloro- 7H- purin- 6- yl)piperidin- 4- yl]methanone
Smiles: O=C(N1CCN(CC1)Cc1ccc2c(c1)OCO2)C1CCN(CC1)c1nc(Cl)nc2c1[nH]cn2

STK629041
Synonyms: 5- (phenoxymethyl)- 4- (quinolin- 5- yl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: S=c1[nH]nc(n1c1cccc2c1cccn2)COc1ccccc1

STK857008
Synonyms: 3- (1,3- benzothiazol- 2- yl)- 6- ethyl- 7- hydroxy- 4H- chromen- 4- one
Smiles: CCc1cc2c(cc1O)occ(c2=O)c1nc2c(s1)cccc2

STK629043
Synonyms: N- [(4- hydroxyphthalazin- 1- yl)acetyl]leucine
Smiles: CC(CC(C(=O)O)NC(=O)Cc1nnc(c2c1cccc2)O)C

STK629044
Synonyms: 2- [4- (4- cyano- 1- methyl- 5,6,7,8- tetrahydroisoquinolin- 3- yl)piperazin- 1- yl]- 2- oxo- N- (tetrahydrofuran- 2- ylmethyl)acetamide
Smiles: N#Cc1c(nc(c2c1CCCC2)C)N1CCN(CC1)C(=O)C(=O)NCC1CCCO1

STK629047
Synonyms: 2- methyl- 5- [(2- methylprop- 2- en- 1- yl)oxy]- 1- benzofuran- 3- carboxylicacid
Smiles: CC(=C)COc1ccc2c(c1)c(C(=O)O)c(o2)C

STK629049
Synonyms: (2Z)- 2- (furan- 2- ylmethylidene)- 8- (4- methoxyphenyl)- 8,9- dihydro- 7H- furo[2,3- f][1,3]benzoxazin- 3(2H)- one
Smiles: COc1ccc(cc1)N1COc2c(C1)c1O/C(=C\c3ccco3)/C(=O)c1cc2

STK629051
Synonyms: N- [2- (5- chloro- 1H- indol- 3- yl)ethyl]- 2- (7H- purin- 6- ylsulfanyl)propanamide
Smiles: O=C(C(Sc1ncnc2c1[nH]cn2)C)NCCc1c[nH]c2c1cc(Cl)cc2

STK629052
Synonyms: N~3~- (2- chloro- 7H- purin- 6- yl)- N- [1- (1H- indol- 3- yl)propan- 2- yl]- beta- alaninamide
Smiles: CC(Cc1c[nH]c2c1cccc2)NC(=O)CCNc1nc(Cl)nc2c1[nH]cn2

STK629058
Synonyms: (5E)- 3- {3- oxo- 3- [2- (pyridin- 3- yl)piperidin- 1- yl]propyl}- 5- [(2E)- 3- phenylprop- 2- en- 1- ylidene]- 1,3- thiazolidine- 2,4- dione
Smiles: O=C(N1CCCCC1c1cccnc1)CCN1C(=O)S/C(=C/C=C/c2ccccc2)/C1=O

STK629059
Synonyms: 1- {[2- methoxy- 5- (4- methyl- 1,1- dioxido- 3- oxo- 1,2- thiazolidin- 2- yl)phenyl]sulfonyl}piperidine- 4- carboxamide
Smiles: COc1ccc(cc1S(=O)(=O)N1CCC(CC1)C(=O)N)N1C(=O)C(CS1(=O)=O)C

STK629061
Synonyms: N- (3- chloro- 4- fluorophenyl)- 7H- purin- 6- amine
Smiles: Fc1ccc(cc1Cl)Nc1ncnc2c1[nH]cn2

STK629062
Synonyms: 3- [(5E)- 5- {[2- (methoxycarbonyl)- 1H- indol- 3- yl]methylidene}- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]propanoicacid
Smiles: COC(=O)c1[nH]c2c(c1/C=C\1/SC(=S)N(C1=O)CCC(=O)O)cccc2

STK629064
Synonyms: 1- methyl- 1- [(2- oxo- 1,2- dihydroquinolin- 4- yl)methyl]- 3- prop- 2- en- 1- ylthiourea
Smiles: C=CCNC(=S)N(Cc1cc(=O)[nH]c2c1cccc2)C

STK629065
Synonyms: 1- (2- chloro- 7H- purin- 6- yl)- N- (2- hydroxyethyl)piperidine- 4- carboxamide
Smiles: OCCNC(=O)C1CCN(CC1)c1nc(Cl)nc2c1[nH]cn2

STK629066
Synonyms: (5- methyl- 7- phenyl- 3,7- dihydro[1,2,4]triazolo[1,5- a]pyrimidin- 6- yl)(phenyl)methanone
Smiles: CC1=C(C(=O)c2ccccc2)C(n2c(=N1)[nH]cn2)c1ccccc1

STK629068
Synonyms: 2- [(2- chloro- 7H- purin- 6- yl)sulfanyl]- N- (furan- 2- ylmethyl)acetamide
Smiles: O=C(NCc1ccco1)CSc1nc(Cl)nc2c1[nH]cn2

STK857009
Synonyms: (2Z)- 2- (5- bromo- 2- methoxybenzylidene)- 8- (pyridin- 3- ylmethyl)- 8,9- dihydro- 7H- furo[2,3- f][1,3]benzoxazin- 3(2H)- one
Smiles: COc1ccc(cc1/C=C/1\Oc2c(C1=O)ccc1c2CN(CO1)Cc1cccnc1)Br

STK629070
Synonyms: 6- benzyl- 3- [(3- methoxypropyl)amino]- 1,2,4- triazin- 5- ol
Smiles: COCCCNc1nnc(c(n1)O)Cc1ccccc1

STK629071
Synonyms: methyl1- (N- {[1- (phenylsulfonyl)piperidin- 4- yl]carbonyl}glycyl)piperidine- 4- carboxylate
Smiles: COC(=O)C1CCN(CC1)C(=O)CNC(=O)C1CCN(CC1)S(=O)(=O)c1ccccc1

STK629074
Synonyms: 2,4- dichloro- N- (pyridin- 3- ylmethyl)- N- [2- (pyrrolidin- 1- ylsulfonyl)ethyl]benzamide
Smiles: Clc1ccc(c(c1)Cl)C(=O)N(Cc1cccnc1)CCS(=O)(=O)N1CCCC1

STK629076
Synonyms: 1- (3- fluorophenyl)- 3- methyl- 4- (naphthalen- 2- yl)- 4,5- dihydro- 1H- pyrazolo[3,4- b]pyridin- 6- ol
Smiles: OC1=Nc2c(C(C1)c1ccc3c(c1)cccc3)c(nn2c1cccc(c1)F)C

STK629077
Synonyms: 2- (4,5- dimethoxy- 3- oxo- 1,3- dihydro- 2- benzofuran- 1- yl)- N- (furan- 2- ylmethyl)acetamide
Smiles: COc1c(OC)ccc2c1C(=O)OC2CC(=O)NCc1ccco1

STK629078
Synonyms: ethyl4- hydroxy- 2- {4- [3- (trifluoromethyl)phenyl]piperazin- 1- yl}pyrimidine- 5- carboxylate
Smiles: CCOC(=O)c1cnc(nc1O)N1CCN(CC1)c1cccc(c1)C(F)(F)F

STK629082
Synonyms: 6- acetyl- 3- (2- hydroxyethyl)- 5- methyl- 1- [2- (piperidin- 1- yl)ethyl]thieno[2,3- d]pyrimidine- 2,4(1H,3H)- dione
Smiles: OCCn1c(=O)n(CCN2CCCCC2)c2c(c1=O)c(C)c(s2)C(=O)C

STK629083
Synonyms: (2Z)- 8- (1,3- benzodioxol- 5- yl)- 2- (3,4,5- trimethoxybenzylidene)- 8,9- dihydro- 7H- furo[2,3- f][1,3]benzoxazin- 3(2H)- one
Smiles: COc1cc(/C=C/2\Oc3c(C2=O)ccc2c3CN(CO2)c2ccc3c(c2)OCO3)cc(c1OC)OC

STK629084
Synonyms: ethyl3- [9- (1,1- dioxido- 2,3- dihydrothiophen- 3- yl)- 4- methyl- 2- oxo- 9,10- dihydro- 2H,8H- chromeno[8,7- e][1,3]oxazin- 3- yl]propanoate
Smiles: CCOC(=O)CCc1c(=O)oc2c(c1C)ccc1c2CN(CO1)C1C=CS(=O)(=O)C1

STK629089
Synonyms: 2- [(4- oxo- 3,4- dihydrospiro[chromene- 2,1'- cyclohexan]- 7- yl)oxy]- N- (pyridin- 2- yl)acetamide
Smiles: O=C(Nc1ccccn1)COc1ccc2c(c1)OC1(CC2=O)CCCCC1

STK629090
Synonyms: 4- chloro- N- [7- (8- methoxyquinolin- 2- yl)- 5- methyl- 3,7- dihydro[1,2,4]triazolo[1,5- a]pyrimidin- 6- yl]benzamide
Smiles: COc1cccc2c1nc(cc2)C1C(=C(C)N=c2n1nc[nH]2)NC(=O)c1ccc(cc1)Cl

STK629091
Synonyms: 5- (4- chlorophenyl)- 2- hydroxy- 1- (tetrahydrofuran- 2- ylmethyl)pyrido[2,3- d]pyrimidin- 4(1H)- one
Smiles: Clc1ccc(cc1)c1ccnc2c1c(=O)nc(n2CC1CCCO1)O

STK629092
Synonyms: 5- amino- 1- (3- chlorophenyl)- N- (thiophen- 2- ylmethyl)- 1H- 1,2,3- triazole- 4- carboxamide
Smiles: Clc1cccc(c1)n1nnc(c1N)C(=O)NCc1cccs1

STK629093
Synonyms: 2- [3- (pyridin- 2- yl)[1,2,4]triazolo[3,4- b][1,3,4]thiadiazol- 6- yl]quinoline
Smiles: c1ccc(nc1)c1nnc2n1nc(s2)c1ccc2c(n1)cccc2

STK629094
Synonyms: 6- (3- bromo- 4- fluorophenyl)- 3- (pyrazin- 2- yl)[1,2,4]triazolo[3,4- b][1,3,4]thiadiazole
Smiles: Fc1ccc(cc1Br)c1nn2c(s1)nnc2c1cnccn1

STK629095
Synonyms: N- [2- (dimethylamino)ethyl]- N'- (2- oxo- 1- propyl- 2,3- dihydro- 1H- indol- 3- yl)ethanediamide
Smiles: CCCN1C(=O)C(c2c1cccc2)NC(=O)C(=O)NCCN(C)C

STK629096
Synonyms: 1- [(4- chlorophenyl)sulfonyl]- N- [2- oxo- 2- (thiomorpholin- 4- yl)ethyl]piperidine- 3- carboxamide
Smiles: O=C(C1CCCN(C1)S(=O)(=O)c1ccc(cc1)Cl)NCC(=O)N1CCSCC1

STK629097
Synonyms: N- [(2S)- 4- (methylsulfanyl)- 1- oxo- 1- (pyridin- 4- ylamino)butan- 2- yl]- 1- (phenylsulfonyl)piperidine- 3- carboxamide
Smiles: CSCC[C@@H](C(=O)Nc1ccncc1)NC(=O)C1CCCN(C1)S(=O)(=O)c1ccccc1

STK629098
Synonyms: 2- [(2Z)- 2- {[(4- methoxyphenyl)sulfonyl]imino}- 2,3- dihydro- 1,3- thiazol- 4- yl]- N- (pyridin- 3- yl)acetamide
Smiles: COc1ccc(cc1)S(=O)(=O)/N=c/1\scc([nH]1)CC(=O)Nc1cccnc1

STK629099
Synonyms: 1- [(4- fluorophenyl)sulfonyl]- N- {(2S)- 1- [(2- methoxybenzyl)amino]- 1- oxopropan- 2- yl}piperidine- 3- carboxamide
Smiles: COc1ccccc1CNC(=O)[C@@H](NC(=O)C1CCCN(C1)S(=O)(=O)c1ccc(cc1)F)C

STK857011
Synonyms: methyl(3- methyl- 2,6- dioxo- 1,2,3,6- tetrahydro- 7H- purin- 7- yl)acetate
Smiles: COC(=O)Cn1cnc2c1c(=O)[nH]c(=O)n2C

STK629102
Synonyms: (2Z)- 2- (4- tert- butylbenzylidene)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yldiethylcarbamate
Smiles: CCN(C(=O)Oc1ccc2c(c1)O/C(=C\c1ccc(cc1)C(C)(C)C)/C2=O)CC

STK629104
Synonyms: 1- (3- hydroxypropyl)- 5- imino- 4- (4- phenyl- 1,3- thiazol- 2- yl)- 2,5- dihydro- 1H- pyrrol- 3- ol
Smiles: OCCCN1CC(=C(C1=N)c1scc(n1)c1ccccc1)O

STK629106
Synonyms: 2,3- dihydro- 1H- indol- 1- yl(1H- indol- 2- yl)methanone
Smiles: O=C(N1CCc2c1cccc2)c1cc2c([nH]1)cccc2

STK629107
Synonyms: 4- [(5E)- 4- oxo- 5- (quinoxalin- 2- ylmethylidene)- 2- thioxo- 1,3- thiazolidin- 3- yl]benzoicacid
Smiles: S=C1S/C(=C/c2cnc3c(n2)cccc3)/C(=O)N1c1ccc(cc1)C(=O)O

STK629108
Synonyms: 4- [(2- hydroxy- 4- oxoquinazolin- 3(4H)- yl)methyl]cyclohexanecarboxylicacid
Smiles: OC(=O)C1CCC(CC1)Cn1c(O)nc2c(c1=O)cccc2

STK629109
Synonyms: 3- (2- bromophenoxy)- 9- (pyridin- 4- ylmethyl)- 9,10- dihydro- 4H,8H- chromeno[8,7- e][1,3]oxazin- 4- one
Smiles: Brc1ccccc1Oc1coc2c(c1=O)ccc1c2CN(CO1)Cc1ccncc1

STK629110
Synonyms: N- (1,1- dioxidotetrahydrothiophen- 3- yl)- N- ethyl- 2- methoxy- 5- (4- methyl- 1,1- dioxido- 3- oxo- 1,2- thiazolidin- 2- yl)benzenesulfonamide
Smiles: CCN(S(=O)(=O)c1cc(ccc1OC)N1C(=O)C(CS1(=O)=O)C)C1CCS(=O)(=O)C1

STK629111
Synonyms: methyl4- [(2- amino- 5- chloro- 3,6- difluoropyridin- 4- yl)oxy]benzoate
Smiles: COC(=O)c1ccc(cc1)Oc1c(F)c(N)nc(c1Cl)F

STK629120
Synonyms: 2- (5,9- dimethyl- 7- oxo- 3- phenyl- 7H- furo[3,2- g]chromen- 6- yl)- N- (4H- 1,2,4- triazol- 4- yl)acetamide
Smiles: O=C(Cc1c(=O)oc2c(c1C)cc1c(c2C)occ1c1ccccc1)Nn1cnnc1

STK629122
Synonyms: (2E)- 2- [(5- methoxy- 1- methyl- 1H- indol- 3- yl)methylidene]- 6- (2- oxopropoxy)- 1- benzofuran- 3(2H)- one
Smiles: COc1ccc2c(c1)c(/C=C\1/Oc3c(C1=O)ccc(c3)OCC(=O)C)cn2C

STK629124
Synonyms: ethyl4- [(4- hydroxyphthalazin- 1- yl)acetyl]piperazine- 1- carboxylate
Smiles: CCOC(=O)N1CCN(CC1)C(=O)Cc1nnc(c2c1cccc2)O

STK629128
Synonyms: N- [1- (2- fluorophenyl)- 2- hydroxy- 5- oxo- 4- (trifluoromethyl)- 4,5- dihydro- 1H- imidazol- 4- yl]- 4- methoxybenzamide
Smiles: COc1ccc(cc1)C(=O)NC1(N=C(N(C1=O)c1ccccc1F)O)C(F)(F)F

STK629129
Synonyms: 4- (2- hydroxy- 4- oxoquinazolin- 3(4H)- yl)- N- (5- methyl- 1,2- oxazol- 3- yl)butanamide
Smiles: O=C(Nc1noc(c1)C)CCCn1c(O)nc2c(c1=O)cccc2

STK629130
Synonyms: (3- benzyl- 1,7- dimethyl- 2,4- dioxo- 1,2,3,4- tetrahydro- 8H- imidazo[2,1- f]purin- 8- yl)aceticacid
Smiles: OC(=O)Cn1c(C)cn2c1nc1c2c(=O)n(c(=O)n1C)Cc1ccccc1

STK629131
Synonyms: (2Z)- 8- (furan- 2- ylmethyl)- 2- (pyridin- 4- ylmethylidene)- 8,9- dihydro- 7H- furo[2,3- f][1,3]benzoxazin- 3(2H)- one
Smiles: O=C1/C(=C/c2ccncc2)/Oc2c1ccc1c2CN(CO1)Cc1ccco1

STK629132
Synonyms: 2- [(3- fluorobenzyl)sulfanyl]- 1- (3- methoxyphenyl)- 3a,4,6,6a- tetrahydro- 1H- thieno[3,4- d]imidazole5,5- dioxide
Smiles: COc1cccc(c1)N1C(=NC2C1CS(=O)(=O)C2)SCc1cccc(c1)F

STK629135
Synonyms: 2- [(2- chloro- 7H- purin- 6- yl)sulfanyl]- N- (3- phenylpropyl)acetamide
Smiles: O=C(CSc1nc(Cl)nc2c1[nH]cn2)NCCCc1ccccc1

STK629138
Synonyms: 1- cyclopropyl- 5- imino- 4- (4- methyl- 1,3- thiazol- 2- yl)- 2,5- dihydro- 1H- pyrrol- 3- ol
Smiles: Cc1csc(n1)C1=C(O)CN(C1=N)C1CC1

STK629139
Synonyms: 5- butyl- 2- [4- (2- hydroxyethyl)piperazin- 1- yl]- 6- methylpyrimidin- 4- ol
Smiles: CCCCc1c(C)nc(nc1O)N1CCN(CC1)CCO

STK629141
Synonyms: methyl(3- {(E)- [1- (3- fluorophenyl)- 4- hydroxy- 2,6- dioxo- 1,6- dihydropyrimidin- 5(2H)- ylidene]methyl}- 1H- indol- 1- yl)acetate
Smiles: COC(=O)Cn1cc(c2c1cccc2)/C=C/1\C(=NC(=O)N(C1=O)c1cccc(c1)F)O

STK629142
Synonyms: 4- bromo- N- [2- (2- oxo- 2,6,7,8- tetrahydrocyclopenta[g]chromen- 4- yl)- 1- benzofuran- 3- yl]benzamide
Smiles: Brc1ccc(cc1)C(=O)Nc1c2ccccc2oc1c1cc(=O)oc2c1cc1CCCc1c2

STK629143
Synonyms: (2E)- 2- [(1- ethyl- 5- methoxy- 1H- indol- 3- yl)methylidene]- 6- [(4- fluorobenzyl)oxy]- 7- methyl- 1- benzofuran- 3(2H)- one
Smiles: COc1ccc2c(c1)c(/C=C\1/Oc3c(C1=O)ccc(c3C)OCc1ccc(cc1)F)cn2CC

STK629145
Synonyms: (2Z)- 8- (3- methoxybenzyl)- 2- (3,4,5- trimethoxybenzylidene)- 8,9- dihydro- 7H- furo[2,3- f][1,3]benzoxazin- 3(2H)- one
Smiles: COc1cccc(c1)CN1COc2c(C1)c1O/C(=C\c3cc(OC)c(c(c3)OC)OC)/C(=O)c1cc2

STK629146
Synonyms: N- (2,5- dimethoxyphenyl)- 2- (5- hydroxy- 4,7- dimethyl- 2- oxo- 2H- chromen- 3- yl)acetamide
Smiles: COc1ccc(cc1NC(=O)Cc1c(=O)oc2c(c1C)c(O)cc(c2)C)OC

STK629147
Synonyms: (2Z)- 2- [(6- chloro- 4H- 1,3- benzodioxin- 8- yl)methylidene]- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl4- chlorobenzoate
Smiles: Clc1ccc(cc1)C(=O)Oc1ccc2c(c1)O/C(=C\c1cc(Cl)cc3c1OCOC3)/C2=O

STK629148
Synonyms: 1- (1H- indol- 2- ylcarbonyl)- N- (propan- 2- yl)piperidine- 3- carboxamide
Smiles: CC(NC(=O)C1CCCN(C1)C(=O)c1cc2c([nH]1)cccc2)C

STK629149
Synonyms: (2Z)- 2- (3- bromobenzylidene)- 8- (pyridin- 4- ylmethyl)- 8,9- dihydro- 7H- furo[2,3- f][1,3]benzoxazin- 3(2H)- one
Smiles: Brc1cccc(c1)/C=C/1\Oc2c(C1=O)ccc1c2CN(CO1)Cc1ccncc1

STK629153
Synonyms: 7,8- dimethoxy- 4- methyl- 3- (2- oxo- 2- {4- [2- (pyridin- 2- yl)ethyl]piperazin- 1- yl}ethyl)- 2H- chromen- 2- one
Smiles: COc1c(OC)ccc2c1oc(=O)c(c2C)CC(=O)N1CCN(CC1)CCc1ccccn1

STK629154
Synonyms: (5E)- 5- {[1- (4- fluorobenzyl)- 1H- pyrrol- 2- yl]methylidene}- 3- (4- fluorophenyl)- 6- hydroxypyrimidine- 2,4(3H,5H)- dione
Smiles: Fc1ccc(cc1)Cn1cccc1/C=C/1\C(=NC(=O)N(C1=O)c1ccc(cc1)F)O

STK629156
Synonyms: 1- [(1- ethylpyrrolidin- 2- yl)methyl]- 5- imino- 4- (4- phenyl- 1,3- thiazol- 2- yl)- 2,5- dihydro- 1H- pyrrol- 3- ol
Smiles: CCN1CCCC1CN1CC(=C(C1=N)c1scc(n1)c1ccccc1)O

STK629158
Synonyms: 4- [(E)- {[3- (1H- benzimidazol- 2- yl)- 4- hydroxy- 2- imino- 2,5- dihydro- 1H- pyrrol- 1- yl]imino}methyl]benzene- 1,2- diol
Smiles: Oc1ccc(cc1O)/C=N/N1CC(=C(C1=N)c1nc2c([nH]1)cccc2)O

STK629161
Synonyms: N- (3- methoxypropyl)- 8,9- dimethylthieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 5- amine
Smiles: COCCCNc1nc2sc(c(c2c2n1ncn2)C)C

STK629162
Synonyms: (5E)- 3- (3- fluorophenyl)- 6- hydroxy- 5- [(1,2,5- trimethyl- 1H- pyrrol- 3- yl)methylidene]pyrimidine- 2,4(3H,5H)- dione
Smiles: Fc1cccc(c1)N1C(=O)N=C(/C(=C\c2cc(n(c2C)C)C)/C1=O)O

STK857013
Synonyms: 5- amino- 1- (4- methylphenyl)- N- (2- phenylethyl)- 1H- 1,2,3- triazole- 4- carboxamide
Smiles: Cc1ccc(cc1)n1nnc(c1N)C(=O)NCCc1ccccc1

STK629171
Synonyms: 9- [4- (dimethylamino)phenyl]- 3- phenyl- 9,10- dihydro- 4H,8H- chromeno[8,7- e][1,3]oxazin- 4- one
Smiles: CN(c1ccc(cc1)N1COc2c(C1)c1occ(c(=O)c1cc2)c1ccccc1)C

STK629172
Synonyms: 3- (3,4- dihydro- 2H- 1,5- benzodioxepin- 7- yl)- 6- ethyl- 2- methyl- 4- oxo- 4H- chromen- 7- yl3,4- dimethoxybenzoate
Smiles: CCc1cc2c(cc1OC(=O)c1ccc(c(c1)OC)OC)oc(c(c2=O)c1ccc2c(c1)OCCCO2)C

STK629173
Synonyms: N- [2- (1,3- dihydro- 2H- benzimidazol- 2- ylideneamino)- 2- oxoethyl]- 4,7- dimethoxy- 1- methyl- 1H- indole- 2- carboxamide
Smiles: COc1ccc(c2c1n(C)c(c2)C(=O)NCC(=O)/N=c/1\[nH]c2c([nH]1)cccc2)OC

STK629175
Synonyms: 1- [(4- fluorophenyl)sulfonyl]- N- (3- methyl- 1- {[(2E)- 4- methyl- 1,3- thiazol- 2(3H)- ylidene]amino}- 1- oxobutan- 2- yl)piperidine- 3- carboxamide
Smiles: CC(C(C(=O)/N=c\1/scc([nH]1)C)NC(=O)C1CCCN(C1)S(=O)(=O)c1ccc(cc1)F)C

STK629178
Synonyms: 4- [3- (1H- indol- 3- yl)propanoyl]- N- {(2S)- 1- [(3- methoxyphenyl)amino]- 1- oxopropan- 2- yl}piperazine- 1- carboxamide
Smiles: COc1cccc(c1)NC(=O)[C@@H](NC(=O)N1CCN(CC1)C(=O)CCc1c[nH]c2c1cccc2)C

STK629181
Synonyms: 6- [2- (3,5- dimethyl- 1- phenyl- 1H- pyrazol- 4- yl)ethyl]- 3- phenyl[1,2,4]triazolo[3,4- b][1,3,4]thiadiazole
Smiles: Cc1nn(c(c1CCc1sc2n(n1)c(nn2)c1ccccc1)C)c1ccccc1

STK629182
Synonyms: 2- {[3- (2- methoxyphenoxy)- 2- methyl- 4- oxo- 4H- chromen- 7- yl]oxy}- N- (4- methylbenzyl)acetamide
Smiles: COc1ccccc1Oc1c(C)oc2c(c1=O)ccc(c2)OCC(=O)NCc1ccc(cc1)C

STK629184
Synonyms: N~2~- (2- chloro- 7H- purin- 6- yl)- N- [2- (6- methoxy- 1H- indol- 3- yl)ethyl]glycinamide
Smiles: COc1ccc2c(c1)[nH]cc2CCNC(=O)CNc1nc(Cl)nc2c1[nH]cn2

STK629186
Synonyms: 2- (hydroxymethyl)- 4- (1- hydroxy- 2- {[6- (4- phenylbutoxy)hexyl]amino}ethyl)phenol
Smiles: OCc1cc(ccc1O)C(CNCCCCCCOCCCCc1ccccc1)O

STK629189
Synonyms: N- {4- [4- (propan- 2- yl)phenyl]- 1,2,5- oxadiazol- 3- yl}thiophene- 2- carboxamide
Smiles: CC(c1ccc(cc1)c1nonc1NC(=O)c1cccs1)C

STK629193
Synonyms: [7- (2- fluorobenzyl)- 3,9- dimethyl- 6,8- dioxo- 6,7,8,9- tetrahydro[1,2,4]triazino[3,4- f]purin- 1(4H)- yl]aceticacid
Smiles: OC(=O)CN1N=C(C)Cn2c1nc1c2c(=O)n(c(=O)n1C)Cc1ccccc1F

STK629199
Synonyms: 1- {[5- (4,4- dimethyl- 1,1- dioxido- 3- oxo- 1,2- thiazolidin- 2- yl)- 2- methoxyphenyl]sulfonyl}piperidine- 4- carboxamide
Smiles: COc1ccc(cc1S(=O)(=O)N1CCC(CC1)C(=O)N)N1C(=O)C(CS1(=O)=O)(C)C

STK857016
Synonyms: 2- butoxy- N- [2- (furan- 2- yl)- 2- (morpholin- 4- yl)ethyl]benzamide
Smiles: CCCCOc1ccccc1C(=O)NCC(c1ccco1)N1CCOCC1

STK629202
Synonyms: 8- (hexylamino)- 3- methyl- 7- (2- methylprop- 2- en- 1- yl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCNc1nc2c(n1CC(=C)C)c(=O)[nH]c(=O)n2C

STK629203
Synonyms: 2- (4- benzylpiperazin- 1- yl)- 6- (3- methoxyphenyl)pyrimidin- 4- ol
Smiles: COc1cccc(c1)c1cc(O)nc(n1)N1CCN(CC1)Cc1ccccc1

STK629204
Synonyms: 9- hydroxy- 7- [4- (pyrimidin- 2- yl)piperazin- 1- yl]- 6,8- diazaspiro[4.5]deca- 6,8- diene- 10- carbonitrile
Smiles: N#CC1C(=NC(=NC21CCCC2)N1CCN(CC1)c1ncccn1)O

STK629208
Synonyms: N- [(2E)- 3- {[(E)- 1H- indol- 3- ylmethylidene]amino}- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]acetamide
Smiles: CC(=O)/N=C\1/SC2C(N1/N=C/c1c[nH]c3c1cccc3)CS(=O)(=O)C2

STK629210
Synonyms: (2E)- N- [2- (dimethylamino)ethyl]- 2- {[(4- fluorophenyl)sulfonyl]imino}- 2,3- dihydro- 1,3- benzothiazole- 6- carboxamide
Smiles: CN(CCNC(=O)c1ccc2c(c1)s/c(=N/S(=O)(=O)c1ccc(cc1)F)/[nH]2)C

STK629212
Synonyms: (2Z)- 2- (2- fluorobenzylidene)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl4- bromobenzenesulfonate
Smiles: Brc1ccc(cc1)S(=O)(=O)Oc1ccc2c(c1)O/C(=C\c1ccccc1F)/C2=O

STK629215
Synonyms: 6- (4- chlorobenzyl)- 3- {[3- (dimethylamino)propyl]amino}- 1,2,4- triazin- 5- ol
Smiles: CN(CCCNc1nnc(c(n1)O)Cc1ccc(cc1)Cl)C

STK629216
Synonyms: 4- [(5Z)- 5- (furan- 2- ylmethylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- [(2R)- 1- hydroxy- 3- phenylpropan- 2- yl]butanamide
Smiles: OCC(Cc1ccccc1)NC(=O)CCCN1C(=S)S/C(=C\c2ccco2)/C1=O

STK629217
Synonyms: 4- {(4- hydroxybenzyl)[2- (morpholin- 4- ylsulfonyl)ethyl]amino}- 4- oxobutanoicacid
Smiles: OC(=O)CCC(=O)N(Cc1ccc(cc1)O)CCS(=O)(=O)N1CCOCC1

STK629220
Synonyms: 1- (furan- 2- ylmethyl)- 2- hydroxy- 5- (4- methoxyphenyl)pyrido[2,3- d]pyrimidin- 4(1H)- one
Smiles: COc1ccc(cc1)c1ccnc2c1c(=O)nc(n2Cc1ccco1)O

STK629221
Synonyms: 3- amino- 7- ethyl- 7- methyl- 7,8- dihydro- 5H- pyrano[4,3- b]thieno[3,2- e]pyridine- 2- carboxylicacid
Smiles: CCC1(C)OCc2c(C1)nc1c(c2)c(c(s1)C(=O)O)N

STK629222
Synonyms: 3- methoxy- N- [3- (8- methylimidazo[1,2- a]pyridin- 2- yl)phenyl]benzamide
Smiles: COc1cccc(c1)C(=O)Nc1cccc(c1)c1cn2c(n1)c(C)ccc2

STK629227
Synonyms: 3- tert- butyl- 6- [5- (2- methylpropyl)- 1H- pyrazol- 3- yl][1,2,4]triazolo[3,4- b][1,3,4]thiadiazole
Smiles: CC(Cc1[nH]nc(c1)c1nn2c(s1)nnc2C(C)(C)C)C

STK629229
Synonyms: 2- [(1'- acetyl- 4- oxo- 3,4- dihydrospiro[chromene- 2,4'- piperidin]- 7- yl)oxy]- N- cyclopropylacetamide
Smiles: O=C(NC1CC1)COc1ccc2c(c1)OC1(CC2=O)CCN(CC1)C(=O)C

STK629234
Synonyms: {(2Z)- 2- [({4,7- dimethyl- 5- [(2- methylprop- 2- en- 1- yl)oxy]- 2- oxo- 2H- chromen- 3- yl}acetyl)imino]- 2,3- dihydro- 1,3- thiazol- 4- yl}aceticacid
Smiles: CC(=C)COc1cc(C)cc2c1c(C)c(c(=O)o2)CC(=O)/N=c/1\scc([nH]1)CC(=O)O

STK629241
Synonyms: 1- (furan- 2- ylmethyl)- 4,5- dimethyl- 3- [(4- methylphenyl)sulfonyl]- 1H- pyrrol- 2- amine
Smiles: Cc1ccc(cc1)S(=O)(=O)c1c(N)n(c(c1C)C)Cc1ccco1

STK629242
Synonyms: 1- (4- hydroxy- 1,1- dioxidotetrahydrothiophen- 3- yl)- 5- imino- 4- (4- phenyl- 1,3- thiazol- 2- yl)- 2,5- dihydro- 1H- pyrrol- 3- ol
Smiles: OC1CS(=O)(=O)CC1N1CC(=C(C1=N)c1scc(n1)c1ccccc1)O

STK857017
Synonyms: methyl4- [(Z)- {3- oxo- 6- [(phenylsulfonyl)oxy]- 1- benzofuran- 2(3H)- ylidene}methyl]benzoate
Smiles: COC(=O)c1ccc(cc1)/C=C/1\Oc2c(C1=O)ccc(c2)OS(=O)(=O)c1ccccc1

STK629244
Synonyms: (2E)- 2- [(1- ethyl- 1H- indol- 3- yl)methylidene]- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl4- methylbenzenesulfonate
Smiles: CCn1cc(c2c1cccc2)/C=C\1/Oc2c(C1=O)ccc(c2)OS(=O)(=O)c1ccc(cc1)C

STK629246
Synonyms: 4- (4,4- dimethyl- 1,1- dioxido- 3- oxo- 1,2- thiazolidin- 2- yl)- 2- methyl- N- (pyridin- 2- yl)benzenesulfonamide
Smiles: O=C1N(c2ccc(c(c2)C)S(=O)(=O)Nc2ccccn2)S(=O)(=O)CC1(C)C

STK629247
Synonyms: 2- {2- [7- (4- methoxyphenyl)- 8,9- dimethyl- 7H- pyrrolo[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 2- yl]ethyl}- 1H- isoindole- 1,3(2H)- dione
Smiles: COc1ccc(cc1)n1c(C)c(c2c1ncn1c2nc(n1)CCN1C(=O)c2c(C1=O)cccc2)C

STK629248
Synonyms: 2- {4,7- dimethyl- 5- [(2- methylprop- 2- en- 1- yl)oxy]- 2- oxo- 2H- chromen- 3- yl}- N- [2- (morpholin- 4- yl)ethyl]acetamide
Smiles: CC(=C)COc1cc(C)cc2c1c(C)c(c(=O)o2)CC(=O)NCCN1CCOCC1

STK857018
Synonyms: 2- (2- phenyl- 1,3- thiazol- 4- yl)- N- (1H- 1,2,4- triazol- 3- yl)acetamide
Smiles: O=C(Nc1n[nH]cn1)Cc1csc(n1)c1ccccc1

STK629251
Synonyms: 4- methyl- 7- (3- methylbutoxy)- 8- propanoyl- 2H- chromen- 2- one
Smiles: CCC(=O)c1c(OCCC(C)C)ccc2c1oc(=O)cc2C

STK629253
Synonyms: 4- (1H- indol- 2- ylcarbonyl)- N- [3- oxo- 3- (propan- 2- ylamino)propyl]piperazine- 1- carboxamide
Smiles: CC(NC(=O)CCNC(=O)N1CCN(CC1)C(=O)c1cc2c([nH]1)cccc2)C

STK629254
Synonyms: (2Z)- 8- (4- methoxybenzyl)- 2- (3,4,5- trimethoxybenzylidene)- 8,9- dihydro- 7H- furo[2,3- f][1,3]benzoxazin- 3(2H)- one
Smiles: COc1ccc(cc1)CN1COc2c(C1)c1O/C(=C\c3cc(OC)c(c(c3)OC)OC)/C(=O)c1cc2

STK629259
Synonyms: 2- [(2- chloro- 7H- purin- 6- yl)sulfanyl]- N- (2- fluorophenyl)acetamide
Smiles: O=C(Nc1ccccc1F)CSc1nc(Cl)nc2c1[nH]cn2

STK629261
Synonyms: 6- [2- (3,5- dimethyl- 1- phenyl- 1H- pyrazol- 4- yl)ethyl]- 3- (3- fluorophenyl)[1,2,4]triazolo[3,4- b][1,3,4]thiadiazole
Smiles: Fc1cccc(c1)c1nnc2n1nc(s2)CCc1c(C)nn(c1C)c1ccccc1

STK629262
Synonyms: 9- (4- bromo- 2- fluorophenyl)- 3- (2- methoxyphenyl)- 9,10- dihydro- 4H,8H- chromeno[8,7- e][1,3]oxazin- 4- one
Smiles: COc1ccccc1c1coc2c(c1=O)ccc1c2CN(CO1)c1ccc(cc1F)Br

STK629266
Synonyms: N- [2- (1H- indol- 3- yl)ethyl]- 2- methoxy- 5- (4- methyl- 1,1- dioxido- 3- oxo- 1,2- thiazolidin- 2- yl)benzenesulfonamide
Smiles: COc1ccc(cc1S(=O)(=O)NCCc1c[nH]c2c1cccc2)N1C(=O)C(CS1(=O)=O)C

STK629267
Synonyms: ethyl4- [(2- hydroxy- 4- oxoquinazolin- 3(4H)- yl)acetyl]piperazine- 1- carboxylate
Smiles: CCOC(=O)N1CCN(CC1)C(=O)Cn1c(O)nc2c(c1=O)cccc2

STK629268
Synonyms: 6- (2- methoxyphenyl)- 2- (4- methylpiperazin- 1- yl)pyrimidin- 4- ol
Smiles: COc1ccccc1c1cc(O)nc(n1)N1CCN(CC1)C

STK629269
Synonyms: 5- (4- methoxyphenyl)- 4- [2- (morpholin- 4- yl)ethyl]- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: COc1ccc(cc1)c1n[nH]c(=S)n1CCN1CCOCC1

STK629271
Synonyms: 4- (1,3- benzodioxol- 5- ylmethyl)- 5- (3,5- dimethoxyphenyl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: COc1cc(OC)cc(c1)c1n[nH]c(=S)n1Cc1ccc2c(c1)OCO2

STK629278
Synonyms: 6- (3- chlorobenzyl)- 3- (4- methoxyphenyl)- 2,5- dimethylpyrazolo[1,5- a]pyrimidin- 7- ol
Smiles: COc1ccc(cc1)c1c(C)nn2c1nc(C)c(c2O)Cc1cccc(c1)Cl

STK629279
Synonyms: N- [3- (dimethylamino)propyl]- N'- (4- hydroxy- 2- oxo- 1,2- dihydropyrimidin- 5- yl)ethanediamide
Smiles: CN(CCCNC(=O)C(=O)Nc1c[nH]c(=O)nc1O)C

STK629284
Synonyms: 2- (trifluoromethyl)pyrimido[1,2- a]benzimidazol- 4- ol
Smiles: Oc1cc(nc2n1c1ccccc1n2)C(F)(F)F

STK629285
Synonyms: 4- (4- chlorophenyl)- 2- [4- (4- methoxyphenyl)piperazin- 1- yl]- 8- methyl- 4,9- dihydro- 6H- pyrimido[1,2- a][1,3,5]triazin- 6- one
Smiles: COc1ccc(cc1)N1CCN(CC1)C1=NC(c2ccc(cc2)Cl)n2c(=N1)[nH]c(cc2=O)C

STK629288
Synonyms: N- (2,4- dimethylphenyl)- 4- hydroxy- 3,6,6- trimethyl- 4,5,6,7- tetrahydro- 1- benzofuran- 2- carboxamide
Smiles: Cc1ccc(c(c1)C)NC(=O)c1oc2c(c1C)C(O)CC(C2)(C)C

STK629289
Synonyms: 6- benzyl- 3- (furan- 2- yl)[1,2,4]triazolo[3,4- a]phthalazine
Smiles: c1ccc(cc1)Cc1nn2c(nnc2c2c1cccc2)c1ccco1

STK629294
Synonyms: methyl2- [3- (6- bromo- 1,3,4,5- tetrahydro- 2H- pyrido[4,3- b]indol- 2- yl)- 2,5- dioxopyrrolidin- 1- yl]benzoate
Smiles: COC(=O)c1ccccc1N1C(=O)CC(C1=O)N1CCc2c(C1)c1cccc(c1[nH]2)Br

STK629297
Synonyms: (5Z)- 5- (4- fluorobenzylidene)- 3- {3- [2- (2- hydroxyethyl)piperidin- 1- yl]- 3- oxopropyl}- 1,3- thiazolidine- 2,4- dione
Smiles: OCCC1CCCCN1C(=O)CCN1C(=O)S/C(=C\c2ccc(cc2)F)/C1=O

STK629298
Synonyms: 6- (4- chlorobenzyl)- 3- (pyridin- 2- ylamino)- 1,2,4- triazin- 5- ol
Smiles: Clc1ccc(cc1)Cc1nnc(nc1O)Nc1ccccn1

STK629301
Synonyms: (2Z)- 2- (biphenyl- 4- ylmethylidene)- 6- (2- oxopropoxy)- 1- benzofuran- 3(2H)- one
Smiles: CC(=O)COc1ccc2c(c1)O/C(=C\c1ccc(cc1)c1ccccc1)/C2=O

STK629303
Synonyms: 2- [3- (4- chlorobenzyl)- 2- hydroxy- 4- oxo- 1,3,8- triazaspiro[4.5]dec- 1- en- 8- yl]- N- (2,4- difluorophenyl)acetamide
Smiles: O=C(Nc1ccc(cc1F)F)CN1CCC2(CC1)N=C(N(C2=O)Cc1ccc(cc1)Cl)O

STK857025
Synonyms: 3- [(5E)- 5- benzylidene- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- (quinoxalin- 6- yl)propanamide
Smiles: O=C(Nc1ccc2c(c1)nccn2)CCN1C(=S)S/C(=C/c2ccccc2)/C1=O

STK629308
Synonyms: 2- [(3- bromo- 6- oxo- 6H- anthra[1,9- cd][1,2]oxazol- 5- yl)amino]ethylpropanoate
Smiles: CCC(=O)OCCNc1cc(Br)c2c3c1C(=O)c1ccccc1c3on2

STK629311
Synonyms: 2- azaspiro[4.4]nonane- 1,3- dione
Smiles: O=C1NC(=O)CC21CCCC2

STK629312
Synonyms: N- (2,4- dichlorobenzyl)- 3- [(4S)- 1- (4- methoxybenzyl)- 2,5- dioxoimidazolidin- 4- yl]propanamide
Smiles: COc1ccc(cc1)CN1C(=O)N[C@H](C1=O)CCC(=O)NCc1ccc(cc1Cl)Cl

STK629313
Synonyms: (4- phenylpiperazin- 1- yl)[2- (1H- pyrrol- 1- yl)- 1,3- benzothiazol- 6- yl]methanone
Smiles: O=C(c1ccc2c(c1)sc(n2)n1cccc1)N1CCN(CC1)c1ccccc1

STK629317
Synonyms: 4- (7- methoxy- 1- benzofuran- 2- yl)- 2- oxo- 7- phenyl- 2H- chromen- 6- yldiethylcarbamate
Smiles: CCN(C(=O)Oc1cc2c(cc1c1ccccc1)oc(=O)cc2c1cc2c(o1)c(OC)ccc2)CC

STK629318
Synonyms: N- (4- fluorophenyl)- 3- (7- hydroxy- 4- methyl- 2- oxo- 2H- chromen- 3- yl)propanamide
Smiles: O=C(Nc1ccc(cc1)F)CCc1c(=O)oc2c(c1C)ccc(c2)O

STK629319
Synonyms: (2,4- dimethoxyphenyl)(1- ethyl- 1H- imidazol- 2- yl)methanol
Smiles: COc1cc(OC)ccc1C(c1nccn1CC)O

STK629321
Synonyms: 5- (3,4- dimethoxyphenyl)- 2- (3- methylphenyl)- 1,2- dihydro- 3H- pyrazol- 3- one
Smiles: COc1cc(ccc1OC)c1[nH]n(c(=O)c1)c1cccc(c1)C

STK629322
Synonyms: 2- [3- (3- chlorophenyl)[1,2,4]triazolo[3,4- b][1,3,4]thiadiazol- 6- yl]- 1H- indole
Smiles: Clc1cccc(c1)c1nnc2n1nc(s2)c1cc2c([nH]1)cccc2

STK629323
Synonyms: 2- (2- hydroxy- 4- oxoquinazolin- 3(4H)- yl)- N- (5- methyl- 1,2- oxazol- 3- yl)acetamide
Smiles: O=C(Cn1c(O)nc2c(c1=O)cccc2)Nc1noc(c1)C

STK629324
Synonyms: 5- (3- methoxyphenyl)- 2- (methylsulfanyl)[1,2,4]triazolo[1,5- a]pyrimidin- 7- ol
Smiles: COc1cccc(c1)c1cc(O)n2c(n1)nc(n2)SC

STK629325
Synonyms: 6- [4- (2- fluorophenyl)piperazin- 1- yl]- 7H- purin- 2- amine
Smiles: Nc1nc2nc[nH]c2c(n1)N1CCN(CC1)c1ccccc1F

STK629326
Synonyms: 1- (2- chloro- 7H- purin- 6- yl)- N- [2- (2- methoxyphenyl)ethyl]piperidine- 3- carboxamide
Smiles: COc1ccccc1CCNC(=O)C1CCCN(C1)c1nc(Cl)nc2c1[nH]cn2

STK629329
Synonyms: 12- acetyl- 10- (butan- 2- yl)- 11a,12- dihydro- 8aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a][1,10]phenanthroline- 9,11(8bH,10H)- dione
Smiles: CCC(N1C(=O)C2C(C1=O)C(N1C2C=Cc2c1c1ncccc1cc2)C(=O)C)C

STK629331
Synonyms: N~2~- (diphenylacetyl)- N- 1,3- thiazol- 2- yl- L- valinamide
Smiles: CC([C@@H](C(=O)Nc1nccs1)NC(=O)C(c1ccccc1)c1ccccc1)C

STK629333
Synonyms: 7- (4- methoxyphenyl)- 8,9- dimethyl- 2- (2- methylpropyl)- 7H- pyrrolo[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: COc1ccc(cc1)n1c(C)c(c2c1ncn1c2nc(n1)CC(C)C)C

STK629334
Synonyms: 1- benzyl- 5- imino- 4- (4- phenyl- 1,3- thiazol- 2- yl)- 2,5- dihydro- 1H- pyrrol- 3- ol
Smiles: OC1=C(c2scc(n2)c2ccccc2)C(=N)N(C1)Cc1ccccc1

STK629335
Synonyms: 5- butyl- 2- [(4,6- dimethylquinazolin- 2- yl)amino]- 6- methylpyrimidin- 4- ol
Smiles: CCCCc1c(C)nc(nc1O)Nc1nc(C)c2c(n1)ccc(c2)C

STK629337
Synonyms: 2- (8,8- dimethyl- 4- oxo- 8,9- dihydro- 4H- pyrano[3',4':5,6]pyrido[2,3- d]pyrimidin- 3(6H)- yl)acetamide
Smiles: NC(=O)Cn1cnc2c(c1=O)cc1c(n2)CC(OC1)(C)C

STK629340
Synonyms: 1- chloro- 3- (2- methyl- 5- nitro- 1H- imidazol- 1- yl)propan- 2- ol
Smiles: ClCC(Cn1c(C)ncc1[N+](=O)[O-])O

STK629341
Synonyms: (5E)- 3- [2- (3,4- dimethoxyphenyl)ethyl]- 5- (quinoxalin- 6- ylmethylidene)- 2- thioxo- 1,3- thiazolidin- 4- one
Smiles: COc1ccc(cc1OC)CCN1C(=S)S/C(=C/c2ccc3c(c2)nccn3)/C1=O

STK629343
Synonyms: 3- (5- bromopyridin- 3- yl)- 6- (4- methoxyphenyl)[1,2,4]triazolo[3,4- b][1,3,4]thiadiazole
Smiles: COc1ccc(cc1)c1nn2c(s1)nnc2c1cncc(c1)Br

STK629348
Synonyms: 2- {3- [(4- methoxyphenoxy)methyl][1,2,4]triazolo[3,4- b][1,3,4]thiadiazol- 6- yl}quinoline
Smiles: COc1ccc(cc1)OCc1nnc2n1nc(s2)c1ccc2c(n1)cccc2

STK629349
Synonyms: 1- (1H- indol- 2- ylcarbonyl)- N- (4- phenylbutan- 2- yl)piperidine- 3- carboxamide
Smiles: CC(NC(=O)C1CCCN(C1)C(=O)c1cc2c([nH]1)cccc2)CCc1ccccc1

STK629350
Synonyms: N- [(2Z)- 4- methyl- 1,3- thiazol- 2(3H)- ylidene]- 3- (4- oxoquinazolin- 3(4H)- yl)propanamide
Smiles: O=C(/N=c/1\scc([nH]1)C)CCn1cnc2c(c1=O)cccc2

STK629352
Synonyms: N- (3- chloro- 4- fluorophenyl)- 1- (1H- indol- 5- ylcarbonyl)piperidine- 3- carboxamide
Smiles: O=C(C1CCCN(C1)C(=O)c1ccc2c(c1)cc[nH]2)Nc1ccc(c(c1)Cl)F

STK629354
Synonyms: 1- benzyl- 2- hydroxy- 5- (2- methoxyphenyl)pyrido[2,3- d]pyrimidin- 4(1H)- one
Smiles: COc1ccccc1c1ccnc2c1c(=O)nc(n2Cc1ccccc1)O

STK629357
Synonyms: (2E)- 2- [(1- ethyl- 1H- indol- 3- yl)methylidene]- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl3,4- dimethoxybenzoate
Smiles: COc1cc(ccc1OC)C(=O)Oc1ccc2c(c1)O/C(=C/c1cn(c3c1cccc3)CC)/C2=O

STK857030
Synonyms: 4- acetyl- 5- (3,4- dimethoxyphenyl)- 3- hydroxy- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: COc1cc(ccc1OC)C1NC(=O)C(=C1C(=O)C)O

STK629361
Synonyms: 3- (2- methoxyphenyl)- 9- (thiophen- 2- ylmethyl)- 2- (trifluoromethyl)- 9,10- dihydro- 4H,8H- chromeno[8,7- e][1,3]oxazin- 4- one
Smiles: COc1ccccc1c1c(=O)c2ccc3c(c2oc1C(F)(F)F)CN(CO3)Cc1cccs1

STK629362
Synonyms: ethyl4- (4- methylphenyl)- 2- (4- methylpiperazin- 1- yl)- 6- oxo- 1,4,5,6- tetrahydropyrimidine- 5- carboxylate
Smiles: CCOC(=O)C1C(=O)NC(=NC1c1ccc(cc1)C)N1CCN(CC1)C

STK629363
Synonyms: N- (1- benzylpiperidin- 4- yl)- 2- [2- (3,4,5- trimethoxyphenyl)- 1,3- thiazol- 4- yl]acetamide
Smiles: COc1cc(cc(c1OC)OC)c1scc(n1)CC(=O)NC1CCN(CC1)Cc1ccccc1

STK629365
Synonyms: [(2E)- 2- {[(6- chloro- 7- methoxy- 4- methyl- 2- oxo- 2H- chromen- 3- yl)acetyl]imino}- 2,3- dihydro- 1,3- thiazol- 4- yl]aceticacid
Smiles: COc1cc2oc(=O)c(c(c2cc1Cl)C)CC(=O)/N=c\1/scc([nH]1)CC(=O)O

STK857033
Synonyms: 2- [(2E)- 3- (2- methoxyphenyl)prop- 2- enoyl]- 4- methylphenylfuran- 2- carboxylate
Smiles: COc1ccccc1/C=C/C(=O)c1cc(C)ccc1OC(=O)c1ccco1

STK629369
Synonyms: N- (2- {1- methyl- 5- [(3- methylbutanoyl)amino]- 1H- benzimidazol- 2- yl}ethyl)- 2,3- dihydro- 1,4- benzodioxine- 2- carboxamide
Smiles: CC(CC(=O)Nc1ccc2c(c1)nc(n2C)CCNC(=O)C1COc2c(O1)cccc2)C

STK629372
Synonyms: 2- hydroxy- 1- (2- methoxyethyl)- 5- (4- methylphenyl)pyrido[2,3- d]pyrimidin- 4(1H)- one
Smiles: COCCn1c(O)nc(=O)c2c1nccc2c1ccc(cc1)C

STK629373
Synonyms: 1- cyclopropyl- N- (1,3- dihydro- 2H- benzimidazol- 2- ylidene)- 7- (4- ethylpiperazin- 1- yl)- 6- fluoro- 4- oxo- 1,4- dihydroquinoline- 3- carboxamide
Smiles: CCN1CCN(CC1)c1cc2c(cc1F)c(=O)c(cn2C1CC1)C(=O)/N=c/1\[nH]c2c([nH]1)cccc2

STK629375
Synonyms: N- (3- chlorophenyl)- 2- [2- (piperidin- 1- yl)ethyl]piperidine- 1- carboxamide
Smiles: Clc1cccc(c1)NC(=O)N1CCCCC1CCN1CCCCC1

STK629376
Synonyms: (E)- N~2~- ({1- [(4- fluorophenyl)sulfonyl]piperidin- 3- yl}carbonyl)- N- (4- methyl- 1,3- thiazol- 2(3H)- ylidene)isoleucinamide
Smiles: CCC(C(C(=O)/N=c\1/scc([nH]1)C)NC(=O)C1CCCN(C1)S(=O)(=O)c1ccc(cc1)F)C

STK629378
Synonyms: 2- {[3- (4- methoxyphenyl)- 4- oxo- 4H- chromen- 7- yl]oxy}- N- (pyridin- 3- yl)acetamide
Smiles: COc1ccc(cc1)c1coc2c(c1=O)ccc(c2)OCC(=O)Nc1cccnc1

STK629383
Synonyms: 4- [4- (2,3- dihydro- 1,4- benzodioxin- 6- ylsulfonyl)- 2- (3,4- dimethoxyphenyl)- 1,3- oxazol- 5- yl]morpholine
Smiles: COc1ccc(cc1OC)c1oc(c(n1)S(=O)(=O)c1ccc2c(c1)OCCO2)N1CCOCC1

STK857034
Synonyms: 2- methoxyethyl5- {[(3- methoxyphenyl)carbonyl]oxy}- 2- methyl- 1- benzofuran- 3- carboxylate
Smiles: COCCOC(=O)c1c(C)oc2c1cc(cc2)OC(=O)c1cccc(c1)OC

STK629389
Synonyms: (2E)- 6- [(2,6- dichlorobenzyl)oxy]- 7- methyl- 2- [(1- methyl- 1H- indol- 3- yl)methylidene]- 1- benzofuran- 3(2H)- one
Smiles: O=C1/C(=C\c2cn(c3c2cccc3)C)/Oc2c1ccc(c2C)OCc1c(Cl)cccc1Cl

STK629390
Synonyms: 4- (4,5- dimethyl- 1,3- thiazol- 2- yl)- 5- imino- 1- (2- methoxyethyl)- 2,5- dihydro- 1H- pyrrol- 3- ol
Smiles: COCCN1CC(=C(C1=N)c1sc(c(n1)C)C)O

STK857035
Synonyms: 1- [5- (2- hydroxyphenyl)- 3- phenyl- 4,5- dihydro- 1H- pyrazol- 1- yl]- 2- methoxy- 2- phenylethanone
Smiles: COC(C(=O)N1N=C(CC1c1ccccc1O)c1ccccc1)c1ccccc1

STK629393
Synonyms: 4- (methylsulfanyl)- 2- {(5E)- 5- [(1- methyl- 1,2,3,4- tetrahydroquinolin- 6- yl)methylidene]- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl}butanoicacid
Smiles: CSCCC(N1C(=S)S/C(=C/c2ccc3c(c2)CCCN3C)/C1=O)C(=O)O

STK629396
Synonyms: 3- {8,9- dimethyl- 2- [({[(1Z)- 1- phenylethylidene]amino}oxy)methyl]- 7H- pyrrolo[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 7- yl}propan- 1- ol
Smiles: OCCCn1c(C)c(c2c1ncn1c2nc(n1)CO/N=C(\c1ccccc1)/C)C

STK629401
Synonyms: 3- (4- fluorophenyl)- 5- methyl- 6- {2- oxo- 2- [4- (pyridin- 2- yl)piperazin- 1- yl]ethyl}- 7H- furo[3,2- g]chromen- 7- one
Smiles: Fc1ccc(cc1)c1coc2c1cc1c(c2)oc(=O)c(c1C)CC(=O)N1CCN(CC1)c1ccccn1

STK629402
Synonyms: 1- (1H- indol- 5- ylcarbonyl)- N- (5- methyl- 1,3- thiazol- 2- yl)piperidine- 3- carboxamide
Smiles: Cc1cnc(s1)NC(=O)C1CCCN(C1)C(=O)c1ccc2c(c1)cc[nH]2

STK629403
Synonyms: (5Z)- 5- ({1- [4- (dimethylamino)phenyl]- 1H- pyrrol- 2- yl}methylidene)- 6- hydroxy- 2- sulfanylpyrimidin- 4(5H)- one
Smiles: SC1=NC(=O)/C(=C\c2cccn2c2ccc(cc2)N(C)C)/C(=N1)O

STK629405
Synonyms: N- [2- (1H- imidazol- 4- yl)ethyl]- N~3~- pyrimidin- 2- yl- beta- alaninamide
Smiles: O=C(CCNc1ncccn1)NCCc1c[nH]cn1

STK629407
Synonyms: 9- [4- (dimethylamino)phenyl]- 2- methyl- 3- phenyl- 9,10- dihydro- 4H,8H- chromeno[8,7- e][1,3]oxazin- 4- one
Smiles: Cc1oc2c3CN(COc3ccc2c(=O)c1c1ccccc1)c1ccc(cc1)N(C)C

STK629408
Synonyms: N- (2- methoxyethyl)- 2- [(4- methyl- 2- oxo- 2H- chromen- 7- yl)oxy]acetamide
Smiles: COCCNC(=O)COc1ccc2c(c1)oc(=O)cc2C

STK629414
Synonyms: 7- hydroxy- 4- methyl- 8- {[(3- methyl- 1,1- dioxidotetrahydrothiophen- 3- yl)amino]methyl}- 2H- chromen- 2- one
Smiles: O=c1cc(C)c2c(o1)c(CNC1(C)CCS(=O)(=O)C1)c(cc2)O

STK629418
Synonyms: methylN- [(1- cyclopropyl- 6,7- difluoro- 8- methoxy- 4- oxo- 1,4- dihydroquinolin- 3- yl)carbonyl]- L- leucinate
Smiles: COC(=O)[C@@H](NC(=O)c1cn(C2CC2)c2c(c1=O)cc(c(c2OC)F)F)CC(C)C

STK629419
Synonyms: N- {1- [(2,4- dimethoxyphenyl)amino]- 4- (methylsulfanyl)- 1- oxobutan- 2- yl}- 3- hydroxyquinoxaline- 1(2H)- carboxamide
Smiles: CSCCC(C(=O)Nc1ccc(cc1OC)OC)NC(=O)N1CC(=Nc2c1cccc2)O

STK857037
Synonyms: (2Z)- 2- [(5- bromo- 1- benzofuran- 2- yl)methylidene]- 7- [(4- methylpiperazin- 1- ium- 1- yl)methyl]- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- olate
Smiles: CN1CC[NH+](CC1)Cc1c([O-])ccc2c1O/C(=C\c1cc3c(o1)ccc(c3)Br)/C2=O

STK629430
Synonyms: (2Z)- 2- (biphenyl- 4- ylmethylidene)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yldimethylcarbamate
Smiles: O=C(N(C)C)Oc1ccc2c(c1)O/C(=C\c1ccc(cc1)c1ccccc1)/C2=O

STK629437
Synonyms: N- [2- (2- methoxyphenyl)ethyl]- 1- (pyrimidin- 2- yl)piperidine- 3- carboxamide
Smiles: COc1ccccc1CCNC(=O)C1CCCN(C1)c1ncccn1

STK629438
Synonyms: 5- bromo- N- (pyridin- 2- ylmethyl)- N- [2- (pyrrolidin- 1- ylsulfonyl)ethyl]furan- 2- carboxamide
Smiles: Brc1ccc(o1)C(=O)N(Cc1ccccn1)CCS(=O)(=O)N1CCCC1

STK629439
Synonyms: methylN- {[4- (1,3- benzoxazol- 2- yl)piperidin- 1- yl]carbonyl}- L- leucinate
Smiles: COC(=O)[C@@H](NC(=O)N1CCC(CC1)c1nc2c(o1)cccc2)CC(C)C

STK629444
Synonyms: 1- (pyrimidin- 2- yl)- N- (1,3- thiazol- 2- yl)piperidine- 3- carboxamide
Smiles: O=C(C1CCCN(C1)c1ncccn1)Nc1nccs1

STK629445
Synonyms: 2- [3- (4- fluorophenyl)[1,2,4]triazolo[3,4- b][1,3,4]thiadiazol- 6- yl]- 1H- indole
Smiles: Fc1ccc(cc1)c1nnc2n1nc(s2)c1cc2c([nH]1)cccc2

STK629448
Synonyms: 1- [4- (2,3- dihydro- 1,4- benzodioxin- 2- ylcarbonyl)piperazin- 1- yl]- 3- (pyrimidin- 2- ylamino)propan- 1- one
Smiles: O=C(N1CCN(CC1)C(=O)C1COc2c(O1)cccc2)CCNc1ncccn1

STK629449
Synonyms: (2Z)- 8- [2- (3,4- dimethoxyphenyl)ethyl]- 2- (pyridin- 3- ylmethylidene)- 8,9- dihydro- 7H- furo[2,3- f][1,3]benzoxazin- 3(2H)- one
Smiles: COc1cc(CCN2COc3c(C2)c2O/C(=C\c4cccnc4)/C(=O)c2cc3)ccc1OC

STK629450
Synonyms: trans- N- (1,1- dioxido- 2,3- dihydrothiophen- 3- yl)- 4- ({[(4- methoxyphenyl)sulfonyl]amino}methyl)cyclohexanecarboxamide
Smiles: COc1ccc(cc1)S(=O)(=O)NC[C@@H]1CC[C@H](CC1)C(=O)NC1C=CS(=O)(=O)C1

STK629451
Synonyms: 4- hydroxy- 1,6,7- trimethyl- 8- {3- [(4- phenoxyphenyl)amino]propyl}- 1H- imidazo[2,1- f]purin- 2(8H)- one
Smiles: Oc1nc(=O)n(c2c1n1c(n2)n(c(c1C)C)CCCNc1ccc(cc1)Oc1ccccc1)C

STK629456
Synonyms: 2- [3- (7- cyclohexyl- 8,9- dimethyl- 7H- pyrrolo[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 2- yl)propyl]- 1H- isoindole- 1,3(2H)- dione
Smiles: O=C1N(CCCc2nn3c(n2)c2c(nc3)n(c(c2C)C)C2CCCCC2)C(=O)c2c1cccc2

STK629457
Synonyms: N- [(2E)- 6- {[4- (2- fluorophenyl)piperazin- 1- yl]carbonyl}- 1,3- benzothiazol- 2(3H)- ylidene]methanesulfonamide
Smiles: O=C(c1ccc2c(c1)s/c(=N/S(=O)(=O)C)/[nH]2)N1CCN(CC1)c1ccccc1F

STK629459
Synonyms: 2- {2- [4- (1,3- benzothiazol- 2- yl)piperidin- 1- yl]ethoxy}benzonitrile
Smiles: N#Cc1ccccc1OCCN1CCC(CC1)c1nc2c(s1)cccc2

STK629460
Synonyms: [(3- chloro- 2,5,6- trifluoropyridin- 4- yl)sulfonyl]aceticacid
Smiles: OC(=O)CS(=O)(=O)c1c(F)c(F)nc(c1Cl)F

STK629462
Synonyms: N- (2- cyanoethyl)- 1- cyclopropyl- 6,7- difluoro- 8- methoxy- N- methyl- 4- oxo- 1,4- dihydroquinoline- 3- carboxamide
Smiles: N#CCCN(C(=O)c1cn(C2CC2)c2c(c1=O)cc(c(c2OC)F)F)C

STK629463
Synonyms: 3- (3- chloro- 1,2- oxazol- 5- yl)- N- [2- (morpholin- 4- ylsulfonyl)ethyl]- N- (pyridin- 2- ylmethyl)propanamide
Smiles: O=C(N(Cc1ccccn1)CCS(=O)(=O)N1CCOCC1)CCc1onc(c1)Cl

STK629467
Synonyms: N- (3- chloro- 4- fluorophenyl)- 1- (7H- purin- 6- yl)piperidine- 3- carboxamide
Smiles: O=C(C1CCCN(C1)c1ncnc2c1[nH]cn2)Nc1ccc(c(c1)Cl)F

STK629468
Synonyms: N- [1- (furan- 2- ylmethyl)- 2- hydroxy- 5- oxo- 4- (trifluoromethyl)- 4,5- dihydro- 1H- imidazol- 4- yl]- 2- methylpropanamide
Smiles: O=C(C(C)C)NC1(N=C(N(C1=O)Cc1ccco1)O)C(F)(F)F

STK629470
Synonyms: 2- methyl- 3- phenyl- 9- (pyridin- 2- ylmethyl)- 9,10- dihydro- 4H,8H- chromeno[8,7- e][1,3]oxazin- 4- one
Smiles: Cc1oc2c3CN(COc3ccc2c(=O)c1c1ccccc1)Cc1ccccn1

STK629471
Synonyms: 2- (2- hydroxy- 4- oxoquinazolin- 3(4H)- yl)- N- (3- methoxyphenyl)- 3- methylbutanamide
Smiles: COc1cccc(c1)NC(=O)C(n1c(O)nc2c(c1=O)cccc2)C(C)C

STK629473
Synonyms: N- (4- methoxybenzyl)- 1- (9H- purin- 6- yl)piperidine- 4- carboxamide
Smiles: COc1ccc(cc1)CNC(=O)C1CCN(CC1)c1ncnc2c1nc[nH]2

STK629478
Synonyms: 6- (3- bromo- 4- fluorophenyl)- 3- (propan- 2- yl)[1,2,4]triazolo[3,4- b][1,3,4]thiadiazole
Smiles: CC(c1nnc2n1nc(s2)c1ccc(c(c1)Br)F)C

STK629481
Synonyms: 5- (4- methoxybenzyl)- 4- (pyridin- 3- yl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: COc1ccc(cc1)Cc1n[nH]c(=S)n1c1cccnc1

STK629484
Synonyms: N- (3- fluorophenyl)- 1- (pyrimidin- 2- yl)piperidine- 4- carboxamide
Smiles: O=C(C1CCN(CC1)c1ncccn1)Nc1cccc(c1)F

STK629485
Synonyms: 3- (3- chloro- 1,2- oxazol- 5- yl)- N- (pyridin- 2- ylmethyl)- N- [2- (pyrrolidin- 1- ylsulfonyl)ethyl]propanamide
Smiles: O=C(N(Cc1ccccn1)CCS(=O)(=O)N1CCCC1)CCc1onc(c1)Cl

STK857042
Synonyms: 4- [(Z)- (6- ethoxy- 3- oxo- 1- benzofuran- 2(3H)- ylidene)methyl]- 2- methoxyphenylmethanesulfonate
Smiles: CCOc1ccc2c(c1)O/C(=C\c1ccc(c(c1)OC)OS(=O)(=O)C)/C2=O

STK629486
Synonyms: 2,2- dimethyl- N- [2- (morpholin- 4- ylsulfonyl)ethyl]- N- (pyridin- 2- ylmethyl)propanamide
Smiles: O=C(C(C)(C)C)N(Cc1ccccn1)CCS(=O)(=O)N1CCOCC1

STK629489
Synonyms: 5- (4- chlorophenyl)- 2- hydroxy- 1- (2- phenylethyl)pyrido[2,3- d]pyrimidin- 4(1H)- one
Smiles: Clc1ccc(cc1)c1ccnc2c1c(=O)nc(n2CCc1ccccc1)O

STK629490
Synonyms: 3- (2- hydroxy- 4- oxoquinazolin- 3(4H)- yl)- N- (5- methyl- 1,2- oxazol- 3- yl)propanamide
Smiles: O=C(Nc1noc(c1)C)CCn1c(O)nc2c(c1=O)cccc2

STK629492
Synonyms: (2E)- 6- [(3- chlorobenzyl)oxy]- 7- methyl- 2- [(1- methyl- 1H- indol- 3- yl)methylidene]- 1- benzofuran- 3(2H)- one
Smiles: Clc1cccc(c1)COc1ccc2c(c1C)O/C(=C/c1cn(c3c1cccc3)C)/C2=O

STK629495
Synonyms: 6,7- dichloro- 5,8- dioxo- 5,8- dihydronaphthalen- 1- ylacetate
Smiles: CC(=O)Oc1cccc2c1C(=O)C(=C(C2=O)Cl)Cl

STK629497
Synonyms: (2Z)- 2- (2- bromobenzylidene)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- ylbenzenesulfonate
Smiles: O=C1/C(=C/c2ccccc2Br)/Oc2c1ccc(c2)OS(=O)(=O)c1ccccc1

STK629498
Synonyms: (4- bromophenyl)[1- (3,4- diethoxybenzyl)- 6,7- diethoxy- 3,4- dihydroisoquinolin- 2(1H)- yl]methanone
Smiles: CCOc1cc(ccc1OCC)CC1N(CCc2c1cc(OCC)c(c2)OCC)C(=O)c1ccc(cc1)Br

STK629500
Synonyms: 1- cyclopropyl- N- (2,4- dimethoxyphenyl)- 7- (4- ethylpiperazin- 1- yl)- 6- fluoro- 4- oxo- 1,4- dihydroquinoline- 3- carboxamide
Smiles: CCN1CCN(CC1)c1cc2c(cc1F)c(=O)c(cn2C1CC1)C(=O)Nc1ccc(cc1OC)OC

STK629501
Synonyms: 2- ethoxy- 4- [2- ({(1S)- 3- methyl- 1- [2- (piperidin- 1- yl)phenyl]butyl}amino)- 2- oxoethyl]benzoicacid
Smiles: CCOc1cc(ccc1C(=O)O)CC(=O)N[C@H](c1ccccc1N1CCCCC1)CC(C)C

STK629502
Synonyms: N- [3- (acetylamino)phenyl]- 2- {[3- (2- methoxyphenoxy)- 2- methyl- 4- oxo- 4H- chromen- 7- yl]oxy}acetamide
Smiles: COc1ccccc1Oc1c(C)oc2c(c1=O)ccc(c2)OCC(=O)Nc1cccc(c1)NC(=O)C

STK629504
Synonyms: 2- {(2E)- 2- [(methylsulfonyl)imino]- 2,3- dihydro- 1,3- thiazol- 4- yl}- N- (pyridin- 3- ylmethyl)acetamide
Smiles: O=C(Cc1cs/c(=N/S(=O)(=O)C)/[nH]1)NCc1cccnc1

STK629512
Synonyms: 2- (4- hydroxyphthalazin- 1- yl)- N- [2- (morpholin- 4- yl)ethyl]acetamide
Smiles: O=C(Cc1nnc(c2c1cccc2)O)NCCN1CCOCC1

STK629517
Synonyms: 2- (2- methoxyphenyl)- 5- (4- methylphenyl)- 1,2- dihydro- 3H- pyrazol- 3- one
Smiles: COc1ccccc1n1[nH]c(cc1=O)c1ccc(cc1)C

STK629520
Synonyms: N- (2,2- dimethoxyethyl)- 1- (pyrimidin- 2- yl)piperidine- 4- carboxamide
Smiles: COC(CNC(=O)C1CCN(CC1)c1ncccn1)OC

STK629522
Synonyms: N- [2- (5- fluoro- 1H- indol- 3- yl)ethyl]- 2- (4- hydroxyphthalazin- 1- yl)acetamide
Smiles: O=C(Cc1nnc(c2c1cccc2)O)NCCc1c[nH]c2c1cc(F)cc2

STK857047
Synonyms: 3- (4- methoxyphenoxy)- 4- oxo- 4H- chromen- 7- ylbenzoate
Smiles: COc1ccc(cc1)Oc1coc2c(c1=O)ccc(c2)OC(=O)c1ccccc1

STK629524
Synonyms: 2- methyl- 3- phenyl- 9- (pyridin- 4- ylmethyl)- 9,10- dihydro- 4H,8H- chromeno[8,7- e][1,3]oxazin- 4- one
Smiles: Cc1oc2c3CN(COc3ccc2c(=O)c1c1ccccc1)Cc1ccncc1

STK629525
Synonyms: (3Z)- 3- (1H- indol- 4- ylmethylidene)- 2- methyl- 2,3- dihydro- 4H- 1,2- benzothiazin- 4- one1,1- dioxide
Smiles: O=C1/C(=C/c2cccc3c2cc[nH]3)/N(C)S(=O)(=O)c2c1cccc2

STK629529
Synonyms: 4- methyl- 2- oxo- 3- [2- oxo- 2- (piperidin- 1- yl)ethyl]- 2H- chromen- 7- ylacetate
Smiles: CC(=O)Oc1ccc2c(c1)oc(=O)c(c2C)CC(=O)N1CCCCC1

STK629531
Synonyms: 2- (2- hydroxy- 4- oxoquinazolin- 3(4H)- yl)- N- (4H- 1,2,4- triazol- 4- yl)acetamide
Smiles: O=C(Cn1c(O)nc2c(c1=O)cccc2)Nn1cnnc1

STK629533
Synonyms: [(5E)- 4- oxo- 5- (quinoxalin- 6- ylmethylidene)- 2- thioxo- 1,3- thiazolidin- 3- yl](phenyl)aceticacid
Smiles: OC(=O)C(N1C(=S)S/C(=C/c2ccc3c(c2)nccn3)/C1=O)c1ccccc1

STK629534
Synonyms: 7- [(3- chlorobenzyl)oxy]- 3- (2- methoxyphenyl)- 2- methyl- 4H- chromen- 4- one
Smiles: COc1ccccc1c1c(C)oc2c(c1=O)ccc(c2)OCc1cccc(c1)Cl

STK629537
Synonyms: (E)- N- (5- ethyl- 1,3,4- thiadiazol- 2(3H)- ylidene)- 1- [(4- methylphenyl)sulfonyl]prolinamide
Smiles: CCc1n[nH]/c(=N\C(=O)C2CCCN2S(=O)(=O)c2ccc(cc2)C)/s1

STK629538
Synonyms: 2- (2- chlorophenyl)- N- cyclopropyl- 4- (2,3- dihydro- 1,4- benzodioxin- 6- ylsulfonyl)- 1,3- oxazol- 5- amine
Smiles: Clc1ccccc1c1oc(c(n1)S(=O)(=O)c1ccc2c(c1)OCCO2)NC1CC1

STK629540
Synonyms: N- [(2E)- 4- (naphthalen- 1- yl)- 1,3- thiazol- 2(3H)- ylidene]cyclopropanecarboxamide
Smiles: O=C(C1CC1)/N=c\1/scc([nH]1)c1cccc2c1cccc2

STK629543
Synonyms: 2- [(2Z)- 2- {[(4- fluorophenyl)sulfonyl]imino}- 2,3- dihydro- 1,3- thiazol- 4- yl]- N- (pyridin- 3- ylmethyl)acetamide
Smiles: O=C(Cc1cs/c(=N\S(=O)(=O)c2ccc(cc2)F)/[nH]1)NCc1cccnc1

STK629548
Synonyms: 3- {[5,6- dimethyl- 7- (pyridin- 2- ylmethyl)- 7H- pyrrolo[2,3- d]pyrimidin- 4- yl]amino}propan- 1- ol
Smiles: OCCCNc1ncnc2c1c(C)c(n2Cc1ccccn1)C

STK629550
Synonyms: 2- (2,5- dimethyl- 1H- pyrrol- 1- yl)- N- [2- (morpholin- 4- yl)ethyl]- 1,3- benzothiazole- 6- carboxamide
Smiles: O=C(c1ccc2c(c1)sc(n2)n1c(C)ccc1C)NCCN1CCOCC1

STK629553
Synonyms: N- (2- bromophenyl)- 2- methoxy- 5- (4- methyl- 1,1- dioxido- 3- oxo- 1,2- thiazolidin- 2- yl)benzenesulfonamide
Smiles: COc1ccc(cc1S(=O)(=O)Nc1ccccc1Br)N1C(=O)C(CS1(=O)=O)C

STK629554
Synonyms: 1- (1H- indol- 3- ylacetyl)- N- (4- methoxybenzyl)piperidine- 3- carboxamide
Smiles: COc1ccc(cc1)CNC(=O)C1CCCN(C1)C(=O)Cc1c[nH]c2c1cccc2

STK629556
Synonyms: N- {3- [(3- chlorophenyl)amino]- 3- oxopropyl}- 4- (1H- indol- 2- ylcarbonyl)piperazine- 1- carboxamide
Smiles: O=C(Nc1cccc(c1)Cl)CCNC(=O)N1CCN(CC1)C(=O)c1cc2c([nH]1)cccc2

STK629565
Synonyms: 3- {[7- (5- bromopyridin- 2- yl)- 5,6- dimethyl- 7H- pyrrolo[2,3- d]pyrimidin- 4- yl]amino}propan- 1- ol
Smiles: OCCCNc1ncnc2c1c(C)c(n2c1ccc(cn1)Br)C

STK629568
Synonyms: N- [2- (5- chloro- 1H- indol- 3- yl)ethyl]- 1- benzofuran- 2- carboxamide
Smiles: Clc1ccc2c(c1)c(CCNC(=O)c1cc3c(o1)cccc3)c[nH]2

STK629569
Synonyms: 3- [(2- chloro- 7H- purin- 6- yl)sulfanyl]- N- (3,4,5- trimethoxyphenyl)propanamide
Smiles: COc1cc(NC(=O)CCSc2nc(Cl)nc3c2[nH]cn3)cc(c1OC)OC

STK629570
Synonyms: N- (4- chlorophenyl)- 1- (1H- indol- 5- ylcarbonyl)piperidine- 3- carboxamide
Smiles: Clc1ccc(cc1)NC(=O)C1CCCN(C1)C(=O)c1ccc2c(c1)cc[nH]2

STK629571
Synonyms: 2- methyl- 1- ({6- [5- (2- methylpropyl)- 1H- pyrazol- 3- yl][1,2,4]triazolo[3,4- b][1,3,4]thiadiazol- 3- yl}methyl)- 1H- benzimidazole
Smiles: CC(Cc1[nH]nc(c1)c1nn2c(s1)nnc2Cn1c(C)nc2c1cccc2)C

STK629573
Synonyms: methyl(7- hydroxy- 2- phenyl[1,2,4]triazolo[1,5- a]pyrimidin- 5- yl)acetate
Smiles: COC(=O)Cc1cc(O)n2c(n1)nc(n2)c1ccccc1

STK629579
Synonyms: N- butyl- N- methyl- 2- (morpholin- 4- yl)- 7,8- dihydro- 6H- thiopyrano[3,2- d]pyrimidin- 4- amine
Smiles: CCCCN(c1nc(nc2c1SCCC2)N1CCOCC1)C

STK629581
Synonyms: 2- [8,9- dimethyl- 7- (pyridin- 4- ylmethyl)- 7H- pyrrolo[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 2- yl]phenol
Smiles: Oc1ccccc1c1nc2n(n1)cnc1c2c(C)c(n1Cc1ccncc1)C

STK629583
Synonyms: 3- (4- methoxyphenyl)- 2- methyl- 9- [2- (morpholin- 4- yl)ethyl]- 9,10- dihydro- 4H,8H- chromeno[8,7- e][1,3]oxazin- 4- one
Smiles: COc1ccc(cc1)c1c(C)oc2c(c1=O)ccc1c2CN(CCN2CCOCC2)CO1

STK629587
Synonyms: 2- {2- [7- (3- methoxyphenyl)- 8,9- dimethyl- 7H- pyrrolo[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 2- yl]ethyl}- 1H- isoindole- 1,3(2H)- dione
Smiles: COc1cccc(c1)n1c(C)c(c2c1ncn1c2nc(n1)CCN1C(=O)c2c(C1=O)cccc2)C

STK629589
Synonyms: 3- [3- (1H- imidazol- 1- yl)propyl]- 5,6- dimethylfuro[2,3- d]pyrimidin- 4(3H)- imine
Smiles: Cc1oc2c(c1C)c(=N)n(cn2)CCCn1cncc1

STK629590
Synonyms: 2- [(2- chloro- 7H- purin- 6- yl)sulfanyl]- N- [2- (5- fluoro- 1H- indol- 3- yl)ethyl]acetamide
Smiles: O=C(CSc1nc(Cl)nc2c1[nH]cn2)NCCc1c[nH]c2c1cc(F)cc2

STK629591
Synonyms: 1- amino- 4- (1,3- benzothiazol- 2- yl)- 5- imino- 2,5- dihydro- 1H- pyrrol- 3- ol
Smiles: OC1=C(c2nc3c(s2)cccc3)C(=N)N(C1)N

STK857052
Synonyms: 3- (4- methoxyphenyl)- 9- (thiophen- 2- ylmethyl)- 9,10- dihydro- 4H,8H- chromeno[8,7- e][1,3]oxazin- 4- one
Smiles: COc1ccc(cc1)c1coc2c(c1=O)ccc1c2CN(CO1)Cc1cccs1

STK857053
Synonyms: ethyl4- {[7- (2- ethoxy- 2- oxoethoxy)- 4- oxo- 4H- chromen- 3- yl]oxy}benzoate
Smiles: CCOC(=O)COc1ccc2c(c1)occ(c2=O)Oc1ccc(cc1)C(=O)OCC

STK629594
Synonyms: 2- [(9- oxo- 1,2,3,9- tetrahydropyrrolo[2,1- b]quinazolin- 7- yl)oxy]- N- [3- (trifluoromethyl)phenyl]acetamide
Smiles: O=C(Nc1cccc(c1)C(F)(F)F)COc1ccc2c(c1)c(=O)n1c(n2)CCC1

STK629597
Synonyms: 3- [(2- chloro- 7H- purin- 6- yl)sulfanyl]- N- [2- (2- methoxyphenyl)ethyl]propanamide
Smiles: COc1ccccc1CCNC(=O)CCSc1nc(Cl)nc2c1[nH]cn2

STK629599
Synonyms: N- [2- ({[trans- 4- (morpholin- 4- ylcarbonyl)cyclohexyl]methyl}amino)- 2- oxoethyl]benzamide
Smiles: O=C(CNC(=O)c1ccccc1)NC[C@@H]1CC[C@H](CC1)C(=O)N1CCOCC1

STK857055
Synonyms: N- [1- (1,1- dioxidotetrahydrothiophen- 3- yl)- 3- phenyl- 1H- pyrazol- 5- yl]methanesulfonamide
Smiles: CS(=O)(=O)Nc1cc(nn1C1CCS(=O)(=O)C1)c1ccccc1

STK629605
Synonyms: N- [2- (4- methoxyphenyl)ethyl]- 1H- indole- 5- carboxamide
Smiles: COc1ccc(cc1)CCNC(=O)c1ccc2c(c1)cc[nH]2

STK629606
Synonyms: 1- cyclopropyl- 6,7- difluoro- 8- methoxy- 3- (thiomorpholin- 4- ylcarbonyl)quinolin- 4(1H)- one
Smiles: COc1c(F)c(F)cc2c1n(cc(c2=O)C(=O)N1CCSCC1)C1CC1

STK629609
Synonyms: 1- [3- (1H- indol- 3- yl)propanoyl]- N- (5- methyl- 1,3- thiazol- 2- yl)piperidine- 3- carboxamide
Smiles: O=C(C1CCCN(C1)C(=O)CCc1c[nH]c2c1cccc2)Nc1ncc(s1)C

STK629610
Synonyms: 4- chloro- N- [7- (1H- indol- 3- yl)- 5- methyl- 3,7- dihydro[1,2,4]triazolo[1,5- a]pyrimidin- 6- yl]benzamide
Smiles: Clc1ccc(cc1)C(=O)NC1=C(C)N=c2n(C1c1c[nH]c3c1cccc3)nc[nH]2

STK629611
Synonyms: 3- [2- (1,4- dioxa- 8- azaspiro[4.5]dec- 8- yl)- 2- oxoethyl]quinazolin- 4(3H)- one
Smiles: O=C(N1CCC2(CC1)OCCO2)Cn1cnc2c(c1=O)cccc2

STK629612
Synonyms: 5- chloro- 1H- indazole- 3- carboxylicacid
Smiles: OC(=O)c1n[nH]c2c1cc(Cl)cc2

STK629615
Synonyms: trans- N- [2- (2,3- dihydro- 1,4- benzodioxin- 6- ylamino)- 2- oxoethyl]- 4- {[(phenylsulfonyl)amino]methyl}cyclohexanecarboxamide
Smiles: O=C(Nc1ccc2c(c1)OCCO2)CNC(=O)[C@@H]1CC[C@H](CC1)CNS(=O)(=O)c1ccccc1

STK629616
Synonyms: 2- amino- 7- [(2,4- dichlorobenzyl)oxy]- 3- (4- methoxyphenyl)- 4H- chromen- 4- one
Smiles: COc1ccc(cc1)c1c(N)oc2c(c1=O)ccc(c2)OCc1ccc(cc1Cl)Cl

STK629620
Synonyms: 2- [(2- methyl- 4- oxo- 3- phenoxy- 4H- chromen- 7- yl)oxy]- N- (3- methylpyridin- 2- yl)acetamide
Smiles: O=C(Nc1ncccc1C)COc1ccc2c(c1)oc(c(c2=O)Oc1ccccc1)C

STK629622
Synonyms: 8- amino- 2- hydroxy- 7- methyl- 3- (1- phenylethyl)benzo[g]pteridin- 4(3H)- one
Smiles: Nc1cc2nc3nc(O)n(c(=O)c3nc2cc1C)C(c1ccccc1)C

STK629624
Synonyms: N- [3- (morpholin- 4- yl)propyl]- 2- (1H- pyrrol- 1- yl)- 1,3- benzothiazole- 6- carboxamide
Smiles: O=C(c1ccc2c(c1)sc(n2)n1cccc1)NCCCN1CCOCC1

STK629630
Synonyms: 3- [2- (2- bromophenyl)- 8,9- dimethyl- 7H- pyrrolo[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 7- yl]propan- 1- ol
Smiles: OCCCn1c(C)c(c2c1ncn1c2nc(n1)c1ccccc1Br)C

STK857057
Synonyms: butyl2- {[3- (4- methoxyphenoxy)- 4- oxo- 4H- chromen- 7- yl]oxy}propanoate
Smiles: CCCCOC(=O)C(Oc1ccc2c(c1)occ(c2=O)Oc1ccc(cc1)OC)C

STK629634
Synonyms: 1- [4- (2,3- dihydro- 1,4- benzodioxin- 6- ylsulfonyl)- 2- (4- methoxyphenyl)- 1,3- oxazol- 5- yl]piperidine- 4- carboxamide
Smiles: COc1ccc(cc1)c1oc(c(n1)S(=O)(=O)c1ccc2c(c1)OCCO2)N1CCC(CC1)C(=O)N

STK629635
Synonyms: 4- (4- bromophenyl)- 3- hydroxy- 1- (propan- 2- yl)- 4,8- dihydro- 1H- pyrazolo[3,4- e][1,4]thiazepin- 7(6H)- one
Smiles: O=C1CSC(c2c(N1)n(nc2O)C(C)C)c1ccc(cc1)Br

STK629636
Synonyms: 2- {4- [3- (4- fluorophenyl)- 5- methylpyrazolo[1,5- a]pyrimidin- 7- yl]piperazin- 1- yl}ethanol
Smiles: OCCN1CCN(CC1)c1cc(C)nc2n1ncc2c1ccc(cc1)F

STK629638
Synonyms: N- [1- (furan- 2- yl)propan- 2- yl]- 2- [(4- oxo- 3,4- dihydrospiro[chromene- 2,1'- cyclohexan]- 7- yl)oxy]acetamide
Smiles: CC(Cc1ccco1)NC(=O)COc1ccc2c(c1)OC1(CC2=O)CCCCC1

STK857059
Synonyms: N- [7,7- dimethyl- 2- (morpholin- 4- ylcarbonyl)- 7,8- dihydro- 5H- pyrano[4,3- b]thieno[3,2- e]pyridin- 3- yl]acetamide
Smiles: CC(=O)Nc1c(sc2c1cc1COC(Cc1n2)(C)C)C(=O)N1CCOCC1

STK629642
Synonyms: 1- {[(5- hydroxy- 2,2- dimethyl- 4- oxo- 3,4- dihydro- 2H- chromen- 7- yl)oxy]acetyl}piperidine- 4- carboxamide
Smiles: O=C(N1CCC(CC1)C(=O)N)COc1cc(O)c2c(c1)OC(CC2=O)(C)C

STK629643
Synonyms: trans- N- [2- (1,3- benzodioxol- 5- ylamino)- 2- oxoethyl]- 4- ({[(4- methylphenyl)sulfonyl]amino}methyl)cyclohexanecarboxamide
Smiles: O=C(Nc1ccc2c(c1)OCO2)CNC(=O)[C@@H]1CC[C@H](CC1)CNS(=O)(=O)c1ccc(cc1)C

STK629645
Synonyms: 2- oxo- 2,3- dihydro- 1H- indole- 5- carboxylicacid
Smiles: O=C1Nc2c(C1)cc(cc2)C(=O)O

STK629647
Synonyms: 2- [4- (4- chlorophenyl)piperazin- 1- yl]- 6- (2- methoxyphenyl)pyrimidin- 4- ol
Smiles: COc1ccccc1c1cc(O)nc(n1)N1CCN(CC1)c1ccc(cc1)Cl

STK629648
Synonyms: trans- 4- ({[(4- methoxyphenyl)sulfonyl]amino}methyl)- N- {(2S)- 1- oxo- 1- [(pyridin- 2- ylmethyl)amino]propan- 2- yl}cyclohexanecarboxamide
Smiles: COc1ccc(cc1)S(=O)(=O)NC[C@@H]1CC[C@H](CC1)C(=O)N[C@H](C(=O)NCc1ccccn1)C

STK629650
Synonyms: N- [1- (1,1- dioxidotetrahydrothiophen- 3- yl)- 3- phenyl- 1H- pyrazol- 5- yl]benzamide
Smiles: O=C(c1ccccc1)Nc1cc(nn1C1CCS(=O)(=O)C1)c1ccccc1

STK629652
Synonyms: 6- (ethylsulfanyl)- 3,3- dimethyl- 8- (piperazin- 1- yl)- 3,4- dihydro- 1H- pyrano[3,4- c]pyridine- 5- carbonitrile
Smiles: CCSc1nc(N2CCNCC2)c2c(c1C#N)CC(OC2)(C)C

STK629654
Synonyms: N- [(2S)- 1- hydroxy- 3- phenylpropan- 2- yl]- N'- (pyridin- 4- yl)ethanediamide
Smiles: OC[C@@H](NC(=O)C(=O)Nc1ccncc1)Cc1ccccc1

STK629658
Synonyms: N- [2- (1H- imidazol- 4- yl)ethyl]- 3- methyl- 4- oxo- 2- phenyl- 4H- chromene- 8- carboxamide
Smiles: O=C(c1cccc2c1oc(c1ccccc1)c(c2=O)C)NCCc1c[nH]cn1

STK629659
Synonyms: 3- (4- methoxyphenyl)- 2- methyl- 5- (propan- 2- yl)pyrazolo[1,5- a]pyrimidin- 7- ol
Smiles: COc1ccc(cc1)c1c(C)nn2c1nc(cc2O)C(C)C

STK629661
Synonyms: 1- (3- chlorophenyl)- 3- (1- methyl- 2- {[(4- methylpyrimidin- 2- yl)sulfanyl]methyl}- 1H- benzimidazol- 5- yl)urea
Smiles: O=C(Nc1ccc2c(c1)nc(n2C)CSc1nccc(n1)C)Nc1cccc(c1)Cl

STK629665
Synonyms: butyl4- [(3E)- 3- (3,4- dihydroxybenzylidene)- 2,5- dioxopyrrolidin- 1- yl]benzoate
Smiles: CCCCOC(=O)c1ccc(cc1)N1C(=O)C/C(=C\c2ccc(c(c2)O)O)/C1=O

STK629669
Synonyms: N- [2- (azepan- 1- ylsulfonyl)ethyl]- N- (pyridin- 2- ylmethyl)acetamide
Smiles: CC(=O)N(Cc1ccccn1)CCS(=O)(=O)N1CCCCCC1

STK629670
Synonyms: trans- 4- ({[(4- chlorophenyl)sulfonyl]amino}methyl)- N- (2- hydroxy- 2- phenylethyl)cyclohexanecarboxamide
Smiles: Clc1ccc(cc1)S(=O)(=O)NC[C@@H]1CC[C@H](CC1)C(=O)NCC(c1ccccc1)O

STK857062
Synonyms: 4- (pyridin- 3- yl)- 5- (thiophen- 2- ylmethyl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: S=c1[nH]nc(n1c1cccnc1)Cc1cccs1

STK629675
Synonyms: ethyl2- (4- ethylpiperazin- 1- yl)- 4- (2- methoxyphenyl)- 6- oxo- 1,4,5,6- tetrahydropyrimidine- 5- carboxylate
Smiles: CCOC(=O)C1C(=O)NC(=NC1c1ccccc1OC)N1CCN(CC1)CC

STK629678
Synonyms: trans- N- {2- [(2,5- dimethoxyphenyl)amino]- 2- oxoethyl}- 4- {[(phenylsulfonyl)amino]methyl}cyclohexanecarboxamide
Smiles: COc1ccc(c(c1)NC(=O)CNC(=O)[C@@H]1CC[C@H](CC1)CNS(=O)(=O)c1ccccc1)OC

STK629679
Synonyms: (2Z)- 2- [(6- chloro- 4H- 1,3- benzodioxin- 8- yl)methylidene]- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl2- methylpropanoate
Smiles: O=C(C(C)C)Oc1ccc2c(c1)O/C(=C\c1cc(Cl)cc3c1OCOC3)/C2=O

STK629680
Synonyms: 2- chloro- N- (2,2- dimethoxyethyl)- 7H- purin- 6- amine
Smiles: COC(CNc1nc(Cl)nc2c1[nH]cn2)OC

STK857064
Synonyms: 3- (1,3- benzothiazol- 2- yl)- 8- methyl- 4- oxo- 4H- chromen- 7- ylacetate
Smiles: CC(=O)Oc1ccc2c(c1C)occ(c2=O)c1nc2c(s1)cccc2

STK857065
Synonyms: 6- ethyl- 3- (4- methyl- 1,3- thiazol- 2- yl)- 4- oxo- 2- (propan- 2- yl)- 4H- chromen- 7- yl2- methylpropanoate
Smiles: CCc1cc2c(cc1OC(=O)C(C)C)oc(c(c2=O)c1scc(n1)C)C(C)C

STK629682
Synonyms: (2E)- 3- [(4- fluorophenyl)amino]- 2- [(4- methoxyphenyl)sulfonyl]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccc(cc1)F)/S(=O)(=O)c1ccc(cc1)OC

STK629684
Synonyms: 2- {[4- (1,2- benzothiazol- 3- yl)piperazin- 1- yl]methyl}- 3- hydroxy- 6- (hydroxymethyl)- 4H- pyran- 4- one
Smiles: OCc1cc(=O)c(c(o1)CN1CCN(CC1)c1nsc2c1cccc2)O

STK629685
Synonyms: 3- {2- [4- (1,2- benzothiazol- 3- yl)piperazin- 1- yl]- 2- oxoethyl}- 5- hydroxy- 4,7- dimethyl- 2H- chromen- 2- one
Smiles: Cc1cc(O)c2c(c1)oc(=O)c(c2C)CC(=O)N1CCN(CC1)c1nsc2c1cccc2

STK629686
Synonyms: 2- (2- methylphenyl)- 5- (trifluoromethyl)- 1,2- dihydro- 3H- pyrazol- 3- one
Smiles: Cc1ccccc1n1[nH]c(cc1=O)C(F)(F)F

STK629687
Synonyms: 1- (2,4- difluorophenyl)- 5- imino- 4- (4- phenyl- 1,3- thiazol- 2- yl)- 2,5- dihydro- 1H- pyrrol- 3- ol
Smiles: Fc1ccc(c(c1)F)N1CC(=C(C1=N)c1scc(n1)c1ccccc1)O

STK629691
Synonyms: 5- amino- N- butyl- 2- (4- methoxyphenyl)- N,4- dimethylthieno[2,3- d]pyrimidine- 6- carboxamide
Smiles: CCCCN(C(=O)c1sc2c(c1N)c(C)nc(n2)c1ccc(cc1)OC)C

STK629693
Synonyms: 5- imino- 4- (4- methyl- 1,3- thiazol- 2- yl)- 1- (1,2,3,4- tetrahydronaphthalen- 1- yl)- 2,5- dihydro- 1H- pyrrol- 3- ol
Smiles: Cc1csc(n1)C1=C(O)CN(C1=N)C1CCCc2c1cccc2

STK629697
Synonyms: 4- chloro- N- [(trans- 4- {[(2S)- 2- (hydroxymethyl)pyrrolidin- 1- yl]carbonyl}cyclohexyl)methyl]benzenesulfonamide
Smiles: OC[C@@H]1CCCN1C(=O)[C@@H]1CC[C@H](CC1)CNS(=O)(=O)c1ccc(cc1)Cl

STK629699
Synonyms: 5,6- dimethyl- 2- [4- (pyridin- 2- yl)piperazin- 1- yl]pyrimidin- 4- ol
Smiles: Cc1nc(nc(c1C)O)N1CCN(CC1)c1ccccn1

STK629700
Synonyms: 1- (1,2- dimethyl- 1H- indol- 3- yl)- 2- [(4- hydroxypyrimidin- 2- yl)sulfanyl]ethanone
Smiles: Oc1ccnc(n1)SCC(=O)c1c(C)n(c2c1cccc2)C

STK629701
Synonyms: N~6~- phenyl- 7H- purine- 2,6- diamine
Smiles: Nc1nc(Nc2ccccc2)c2c(n1)nc[nH]2

STK629703
Synonyms: (4- ethylpiperazin- 1- yl)[2- (1H- pyrrol- 1- yl)- 1,3- benzothiazol- 6- yl]methanone
Smiles: CCN1CCN(CC1)C(=O)c1ccc2c(c1)sc(n2)n1cccc1

STK629704
Synonyms: 4- amino- N- (furan- 2- ylmethyl)- 3- [3- (morpholin- 4- yl)propyl]- 2- thioxo- 2,3- dihydro- 1,3- thiazole- 5- carboxamide
Smiles: O=C(c1sc(=S)n(c1N)CCCN1CCOCC1)NCc1ccco1

STK857071
Synonyms: 2- methylpropyl2- {[3- (2- chlorophenoxy)- 4- oxo- 4H- chromen- 7- yl]oxy}propanoate
Smiles: CC(COC(=O)C(Oc1ccc2c(c1)occ(c2=O)Oc1ccccc1Cl)C)C

STK857072
Synonyms: N- (1,3- benzodioxol- 5- yl)- 7H- purin- 6- amine
Smiles: C1Oc2c(O1)cc(cc2)Nc1ncnc2c1[nH]cn2

STK629709
Synonyms: 2- (6- chloro- 9H- carbazol- 2- yl)- N- (2- hydroxy- 3- methoxypropyl)propanamide
Smiles: COCC(CNC(=O)C(c1ccc2c(c1)[nH]c1c2cc(cc1)Cl)C)O

STK629714
Synonyms: 2- (4- fluorophenoxy)- N- (4,5,6,7- tetrahydro- 2,1- benzoxazol- 3- yl)butanamide
Smiles: CCC(C(=O)Nc1onc2c1CCCC2)Oc1ccc(cc1)F

STK629716
Synonyms: 3- cyano- 5- methyl- N- phenyl- 7- (thiophen- 2- yl)- 1,7- dihydropyrazolo[1,5- a]pyrimidine- 6- carboxamide
Smiles: N#Cc1c[nH]n2c1=NC(=C(C2c1cccs1)C(=O)Nc1ccccc1)C

STK629718
Synonyms: [2- (2- phenylethoxy)phenyl]phosphonicacid
Smiles: OP(=O)(c1ccccc1OCCc1ccccc1)O

STK629719
Synonyms: methyl({(2E)- 2- [(1- methyl- 1H- indol- 3- yl)methylidene]- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl}oxy)acetate
Smiles: COC(=O)COc1ccc2c(c1)O/C(=C/c1cn(c3c1cccc3)C)/C2=O

STK629722
Synonyms: 9- (3- chloro- 4- fluorophenyl)- 3- (2- methoxyphenyl)- 9,10- dihydro- 4H,8H- chromeno[8,7- e][1,3]oxazin- 4- one
Smiles: COc1ccccc1c1coc2c(c1=O)ccc1c2CN(CO1)c1ccc(c(c1)Cl)F

STK629723
Synonyms: N- [2- (3,4- dimethoxyphenyl)ethyl]- 1- [N- (phenylcarbonyl)glycyl]piperidine- 4- carboxamide
Smiles: COc1cc(CCNC(=O)C2CCN(CC2)C(=O)CNC(=O)c2ccccc2)ccc1OC

STK629727
Synonyms: 2- (4- ethylpiperazin- 1- yl)- 6- {[(5- methyl- 1,3,4- thiadiazol- 2- yl)sulfanyl]methyl}pyrimidin- 4- ol
Smiles: CCN1CCN(CC1)c1nc(CSc2nnc(s2)C)cc(n1)O

STK629728
Synonyms: N- (2- methoxyphenyl)- 2- [(2- methyl- 4- oxo- 3- phenyl- 4H- chromen- 7- yl)oxy]acetamide
Smiles: COc1ccccc1NC(=O)COc1ccc2c(c1)oc(c(c2=O)c1ccccc1)C

STK629729
Synonyms: S- (6- fluoro- 2- methylquinolin- 4- yl)- N- (phenylcarbonyl)cysteine
Smiles: OC(=O)C(NC(=O)c1ccccc1)CSc1cc(C)nc2c1cc(F)cc2

STK629731
Synonyms: benzyl{[(2Z)- 2- (3- bromobenzylidene)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl]oxy}acetate
Smiles: O=C(OCc1ccccc1)COc1ccc2c(c1)O/C(=C\c1cccc(c1)Br)/C2=O

STK629733
Synonyms: 2- methyl- N- [2- (2- oxo- 2,6,7,8- tetrahydrocyclopenta[g]chromen- 4- yl)- 1- benzofuran- 3- yl]benzamide
Smiles: O=c1oc2cc3CCCc3cc2c(c1)c1oc2c(c1NC(=O)c1ccccc1C)cccc2

STK857076
Synonyms: ethyl3- (4- methoxyphenyl)- 7- [(methylsulfonyl)oxy]- 4- oxo- 4H- chromene- 2- carboxylate
Smiles: CCOC(=O)c1oc2cc(ccc2c(=O)c1c1ccc(cc1)OC)OS(=O)(=O)C

STK629735
Synonyms: N- {[4- (1H- indol- 2- ylcarbonyl)piperazin- 1- yl]carbonyl}- beta- alanine
Smiles: OC(=O)CCNC(=O)N1CCN(CC1)C(=O)c1cc2c([nH]1)cccc2

STK629737
Synonyms: 4- {3- cyano- 5- methyl- 6- [(2- methylphenyl)carbamoyl]- 1,7- dihydropyrazolo[1,5- a]pyrimidin- 7- yl}benzoicacid
Smiles: N#Cc1c[nH]n2c1=NC(=C(C2c1ccc(cc1)C(=O)O)C(=O)Nc1ccccc1C)C

STK629743
Synonyms: (2Z)- 8- (furan- 2- ylmethyl)- 2- (3,4,5- trimethoxybenzylidene)- 8,9- dihydro- 7H- furo[2,3- f][1,3]benzoxazin- 3(2H)- one
Smiles: COc1cc(/C=C/2\Oc3c(C2=O)ccc2c3CN(CO2)Cc2ccco2)cc(c1OC)OC

STK629745
Synonyms: 3- (4- methoxyphenyl)- 9- [2- (morpholin- 4- yl)ethyl]- 9,10- dihydro- 4H,8H- chromeno[8,7- e][1,3]oxazin- 4- one
Smiles: COc1ccc(cc1)c1coc2c(c1=O)ccc1c2CN(CCN2CCOCC2)CO1

STK629750
Synonyms: 5- chloro- 2- (ethylsulfanyl)- N- (pyridin- 2- yl)pyrimidine- 4- carboxamide
Smiles: CCSc1ncc(c(n1)C(=O)Nc1ccccn1)Cl

STK629753
Synonyms: 2- [(2- chloro- 7H- purin- 6- yl)sulfanyl]- N- (3,4- dimethoxyphenyl)acetamide
Smiles: COc1cc(ccc1OC)NC(=O)CSc1nc(Cl)nc2c1[nH]cn2

STK629754
Synonyms: methyl4- chloro- 2- ({(E)- 2- cyano- 2- [(4- methoxyphenyl)sulfonyl]ethenyl}amino)benzoate
Smiles: COc1ccc(cc1)S(=O)(=O)/C(=C/Nc1cc(Cl)ccc1C(=O)OC)/C#N

STK629756
Synonyms: 3- [3- (phenoxymethyl)[1,2,4]triazolo[3,4- b][1,3,4]thiadiazol- 6- yl]- 1H- indole
Smiles: c1ccc(cc1)OCc1nnc2n1nc(s2)c1c[nH]c2c1cccc2

STK629757
Synonyms: N- (2,3- dimethylphenyl)- 2- {[3- (2- methoxyphenoxy)- 2- methyl- 4- oxo- 4H- chromen- 7- yl]oxy}acetamide
Smiles: COc1ccccc1Oc1c(C)oc2c(c1=O)ccc(c2)OCC(=O)Nc1cccc(c1C)C

STK629762
Synonyms: 2- {[3- (4- chlorophenyl)- 2- methyl- 4- oxo- 4H- chromen- 7- yl]oxy}- N- (1,1- dioxido- 2,3- dihydrothiophen- 3- yl)acetamide
Smiles: O=C(NC1C=CS(=O)(=O)C1)COc1ccc2c(c1)oc(c(c2=O)c1ccc(cc1)Cl)C

STK629767
Synonyms: ethyl4- hydroxy- 6- oxo- 1,2- dihydro- 6H- pyrrolo[3,2,1- ij]quinoline- 5- carboxylate
Smiles: CCOC(=O)c1c(O)n2CCc3c2c(c1=O)ccc3

STK629769
Synonyms: 5- (2,4- difluorophenyl)- 4- (2,3- dihydro- 1,4- benzodioxin- 6- yl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: Fc1ccc(c(c1)F)c1n[nH]c(=S)n1c1ccc2c(c1)OCCO2

STK629771
Synonyms: N- (4- chlorobenzyl)- 2- (7H- purin- 6- ylsulfanyl)propanamide
Smiles: O=C(C(Sc1ncnc2c1[nH]cn2)C)NCc1ccc(cc1)Cl

STK629772
Synonyms: 2- hydroxy- 5- oxo- 7- (thiophen- 2- yl)- 5,6,7,8- tetrahydroquinoline- 3- carboxylicacid
Smiles: O=C1CC(Cc2c1cc(C(=O)O)c(n2)O)c1cccs1

STK629773
Synonyms: 5- amino- 2- (4- chlorophenyl)- N- (furan- 2- ylmethyl)- 4- methylthieno[2,3- d]pyrimidine- 6- carboxamide
Smiles: Clc1ccc(cc1)c1nc(C)c2c(n1)sc(c2N)C(=O)NCc1ccco1

STK629774
Synonyms: N- {(2S)- 1- [(3- chlorophenyl)amino]- 1- oxopropan- 2- yl}- 4- (1H- indol- 2- ylcarbonyl)piperazine- 1- carboxamide
Smiles: Clc1cccc(c1)NC(=O)[C@@H](NC(=O)N1CCN(CC1)C(=O)c1cc2c([nH]1)cccc2)C

STK629775
Synonyms: 4- methyl- 2- (3- methylphenyl)- 6- {[2- (piperidin- 1- yl)ethyl]sulfanyl}pyrimidine- 5- carboxylicacid
Smiles: Cc1cccc(c1)c1nc(SCCN2CCCCC2)c(c(n1)C)C(=O)O

STK629776
Synonyms: 3,9- bis(4- methoxyphenyl)- 9,10- dihydro- 4H,8H- chromeno[8,7- e][1,3]oxazin- 4- one
Smiles: COc1ccc(cc1)N1COc2c(C1)c1occ(c(=O)c1cc2)c1ccc(cc1)OC

STK629779
Synonyms: 3- (5- bromopyridin- 3- yl)- 6- (2- fluorophenyl)[1,2,4]triazolo[3,4- b][1,3,4]thiadiazole
Smiles: Brc1cncc(c1)c1nnc2n1nc(s2)c1ccccc1F

STK857081
Synonyms: (2Z)- 2- (2,5- dimethoxybenzylidene)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl4- fluorobenzenesulfonate
Smiles: COc1ccc(cc1/C=C/1\Oc2c(C1=O)ccc(c2)OS(=O)(=O)c1ccc(cc1)F)OC

STK629783
Synonyms: N- (2- phenyl- 1H- indol- 3- yl)- N'- [2- (piperidin- 1- yl)ethyl]ethanediamide
Smiles: O=C(C(=O)NCCN1CCCCC1)Nc1c([nH]c2c1cccc2)c1ccccc1

STK629785
Synonyms: 6- {1- [4- (2- methylpropyl)phenyl]ethyl}- 3- (pyridin- 4- yl)[1,2,4]triazolo[3,4- b][1,3,4]thiadiazole
Smiles: CC(Cc1ccc(cc1)C(c1nn2c(s1)nnc2c1ccncc1)C)C

STK629786
Synonyms: 8,9- dimethyl- N- (propan- 2- yl)thieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 5- amine
Smiles: CC(Nc1nc2sc(c(c2c2n1ncn2)C)C)C

STK629787
Synonyms: (2E)- 4- oxo- 4- {(pyridin- 3- ylmethyl)[2- (pyrrolidin- 1- ylsulfonyl)ethyl]amino}but- 2- enoicacid
Smiles: OC(=O)/C=C/C(=O)N(Cc1cccnc1)CCS(=O)(=O)N1CCCC1

STK629788
Synonyms: N- [3- (1,3- benzodioxol- 5- ylamino)- 3- oxopropyl]- 4- (1H- indol- 3- ylcarbonyl)piperazine- 1- carboxamide
Smiles: O=C(Nc1ccc2c(c1)OCO2)CCNC(=O)N1CCN(CC1)C(=O)c1c[nH]c2c1cccc2

STK629790
Synonyms: N~2~- [(4- hydroxyphthalazin- 1- yl)acetyl]- N- 1,3- thiazol- 2- ylalaninamide
Smiles: O=C(Cc1nnc(c2c1cccc2)O)NC(C(=O)Nc1nccs1)C

STK629794
Synonyms: 4- (4,5- dimethyl- 1,3- thiazol- 2- yl)- 5- imino- 1- (3- methoxypropyl)- 2,5- dihydro- 1H- pyrrol- 3- ol
Smiles: COCCCN1CC(=C(C1=N)c1sc(c(n1)C)C)O

STK629796
Synonyms: 1- (2- chloro- 7H- purin- 6- yl)- N- (5- hydroxypentyl)piperidine- 4- carboxamide
Smiles: OCCCCCNC(=O)C1CCN(CC1)c1nc(Cl)nc2c1[nH]cn2

STK857082
Synonyms: N- (3- chlorophenyl)- 2,3- dihydrothiophen- 3- amine1,1- dioxide
Smiles: Clc1cccc(c1)NC1C=CS(=O)(=O)C1

STK629799
Synonyms: (2- {2- [(4- fluorophenyl)amino]- 2- oxoethoxy}phenyl)phosphonicacid
Smiles: O=C(Nc1ccc(cc1)F)COc1ccccc1P(=O)(O)O

STK629800
Synonyms: (3R)- N- [4- (acetylamino)phenyl]- 5- oxo- 2,3,5,9b- tetrahydro[1,3]thiazolo[2,3- a]isoindole- 3- carboxamide
Smiles: CC(=O)Nc1ccc(cc1)NC(=O)[C@@H]1CSC2N1C(=O)c1c2cccc1

STK629805
Synonyms: N~2~- (2- chloro- 7H- purin- 6- yl)- N- [3- (morpholin- 4- yl)propyl]glycinamide
Smiles: O=C(CNc1nc(Cl)nc2c1[nH]cn2)NCCCN1CCOCC1

STK629806
Synonyms: 1- [(4- chlorophenyl)sulfonyl]- N- {2- [(3- hydroxyphenyl)amino]- 2- oxoethyl}piperidine- 3- carboxamide
Smiles: O=C(Nc1cccc(c1)O)CNC(=O)C1CCCN(C1)S(=O)(=O)c1ccc(cc1)Cl

STK629808
Synonyms: 1- [(4- methoxyphenyl)sulfonyl]- N- (4- methylpiperazin- 1- yl)piperidine- 3- carboxamide
Smiles: COc1ccc(cc1)S(=O)(=O)N1CCCC(C1)C(=O)NN1CCN(CC1)C

STK629809
Synonyms: N- {4- [3- (6- bromo- 1,3,4,5- tetrahydro- 2H- pyrido[4,3- b]indol- 2- yl)- 2,5- dioxopyrrolidin- 1- yl]phenyl}acetamide
Smiles: CC(=O)Nc1ccc(cc1)N1C(=O)CC(C1=O)N1CCc2c(C1)c1cccc(c1[nH]2)Br

STK629810
Synonyms: N~2~- [(4- hydroxyphthalazin- 1- yl)acetyl]- N- (2,2,6,6- tetramethylpiperidin- 4- yl)glycinamide
Smiles: O=C(Cc1nnc(c2c1cccc2)O)NCC(=O)NC1CC(C)(C)NC(C1)(C)C

STK629812
Synonyms: (2Z)- 2- (2,3- dimethoxybenzylidene)- 8- (tetrahydrofuran- 2- ylmethyl)- 8,9- dihydro- 7H- furo[2,3- f][1,3]benzoxazin- 3(2H)- one
Smiles: COc1c(cccc1OC)/C=C/1\Oc2c(C1=O)ccc1c2CN(CO1)CC1CCCO1

STK629814
Synonyms: 7- methoxy- N- (pyridin- 4- yl)- 1- benzofuran- 2- carboxamide
Smiles: COc1cccc2c1oc(c2)C(=O)Nc1ccncc1

STK629815
Synonyms: (2Z)- 7- {[bis(2- methylpropyl)ammonio]methyl}- 2- [(3- methylthiophen- 2- yl)methylidene]- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- olate
Smiles: CC(C[NH+](Cc1c([O-])ccc2c1O/C(=C\c1sccc1C)/C2=O)CC(C)C)C

STK629817
Synonyms: 4- benzyl- N- (4- hydroxy- 6- methylpyrimidin- 2- yl)piperidine- 1- carboximidamide
Smiles: Cc1nc(nc(c1)O)NC(=N)N1CCC(CC1)Cc1ccccc1

STK629819
Synonyms: (2Z)- 8- (furan- 2- ylmethyl)- 2- (thiophen- 2- ylmethylidene)- 8,9- dihydro- 7H- furo[2,3- f][1,3]benzoxazin- 3(2H)- one
Smiles: O=C1/C(=C/c2cccs2)/Oc2c1ccc1c2CN(CO1)Cc1ccco1

STK629821
Synonyms: N- (2- cyanoethyl)- N- methyl- 1- {[4- (2- oxopyrrolidin- 1- yl)phenyl]sulfonyl}piperidine- 3- carboxamide
Smiles: N#CCCN(C(=O)C1CCCN(C1)S(=O)(=O)c1ccc(cc1)N1CCCC1=O)C

STK857084
Synonyms: 3- (4- methoxyphenoxy)- 4- oxo- 4H- chromen- 7- yl(2E)- 3- phenylprop- 2- enoate
Smiles: COc1ccc(cc1)Oc1coc2c(c1=O)ccc(c2)OC(=O)/C=C/c1ccccc1

STK629824
Synonyms: 3- [2- (dimethylamino)ethyl]- 2- (3- methylphenyl)quinazolin- 4(3H)- one
Smiles: CN(CCn1c(nc2c(c1=O)cccc2)c1cccc(c1)C)C

STK629826
Synonyms: 2- (2- hydroxy- 4- oxoquinazolin- 3(4H)- yl)- N- methyl- N- [2- (pyridin- 2- yl)ethyl]acetamide
Smiles: CN(C(=O)Cn1c(O)nc2c(c1=O)cccc2)CCc1ccccn1

STK629827
Synonyms: 1- (4- fluorophenyl)- 5- imino- 4- (4- methyl- 1,3- thiazol- 2- yl)- 2,5- dihydro- 1H- pyrrol- 3- ol
Smiles: Fc1ccc(cc1)N1CC(=C(C1=N)c1scc(n1)C)O

STK629832
Synonyms: 2- (4,6- dimethylpyrimidin- 2- yl)- 6- hydroxypyridazin- 3(2H)- one
Smiles: Cc1cc(C)nc(n1)n1nc(O)ccc1=O

STK629835
Synonyms: 3- [3- (trifluoromethyl)[1,2,4]triazolo[3,4- b][1,3,4]thiadiazol- 6- yl]- 1H- indole
Smiles: FC(c1nnc2n1nc(s2)c1c[nH]c2c1cccc2)(F)F

STK629837
Synonyms: N- (3- chlorophenyl)- 1- (9H- purin- 6- yl)piperidine- 4- carboxamide
Smiles: O=C(C1CCN(CC1)c1ncnc2c1nc[nH]2)Nc1cccc(c1)Cl

STK629838
Synonyms: 2- {[(4,6- dimethylpyrimidin- 2- yl)sulfanyl]methyl}pyrimido[1,2- a]benzimidazol- 4- ol
Smiles: Cc1cc(C)nc(n1)SCc1cc(O)n2c(n1)nc1c2cccc1

STK629841
Synonyms: 7- {2- [4- (2- hydroxyethyl)piperazin- 1- yl]- 2- oxoethoxy}- 4- phenyl- 2H- chromen- 2- one
Smiles: OCCN1CCN(CC1)C(=O)COc1ccc2c(c1)oc(=O)cc2c1ccccc1

STK629842
Synonyms: 6- (naphthalen- 1- yl)- 3- (2- phenylethyl)[1,2,4]triazolo[3,4- b][1,3,4]thiadiazole
Smiles: c1ccc(cc1)CCc1nnc2n1nc(s2)c1cccc2c1cccc2

STK629844
Synonyms: 2- (3- methylphenyl)- 5- phenyl- 1,2- dihydro- 3H- pyrazol- 3- one
Smiles: Cc1cccc(c1)n1[nH]c(cc1=O)c1ccccc1

STK629845
Synonyms: 2- {[3- (4- chlorophenyl)- 2- methyl- 4- oxo- 4H- chromen- 7- yl]oxy}- N- (3- ethoxypropyl)acetamide
Smiles: CCOCCCNC(=O)COc1ccc2c(c1)oc(c(c2=O)c1ccc(cc1)Cl)C

STK629847
Synonyms: 4- (4,5- dimethyl- 1,3- thiazol- 2- yl)- 5- imino- 1- phenyl- 2,5- dihydro- 1H- pyrrol- 3- ol
Smiles: OC1=C(c2sc(c(n2)C)C)C(=N)N(C1)c1ccccc1

STK857085
Synonyms: methyl{[3- (2,3- dihydro- 1,4- benzodioxin- 6- yl)- 4- oxo- 4H- chromen- 7- yl]oxy}acetate
Smiles: COC(=O)COc1ccc2c(c1)occ(c2=O)c1ccc2c(c1)OCCO2

STK629849
Synonyms: N- [2- (diethylamino)ethyl]- N'- (quinolin- 5- yl)ethanediamide
Smiles: CCN(CCNC(=O)C(=O)Nc1cccc2c1cccn2)CC

STK857086
Synonyms: 2- {[3- (3- methoxyphenoxy)- 4- oxo- 4H- chromen- 7- yl]oxy}acetamide
Smiles: COc1cccc(c1)Oc1coc2c(c1=O)ccc(c2)OCC(=O)N

STK629851
Synonyms: N- [2- (dimethylamino)- 2- (furan- 2- yl)ethyl]- 4- (prop- 2- en- 1- yloxy)benzamide
Smiles: C=CCOc1ccc(cc1)C(=O)NCC(c1ccco1)N(C)C

STK629853
Synonyms: N- (butan- 2- yl)- 2- [(4- methyl- 2- oxo- 2H- chromen- 7- yl)oxy]acetamide
Smiles: CCC(NC(=O)COc1ccc2c(c1)oc(=O)cc2C)C

STK629854
Synonyms: 3- benzyl- 2- (pyridin- 3- ylmethyl)- 3,4- dihydro- 2H- 1,2- benzothiazin- 4- ol1,1- dioxide
Smiles: OC1C(Cc2ccccc2)N(Cc2cccnc2)S(=O)(=O)c2c1cccc2

STK629856
Synonyms: 4- (2,1,3- benzoxadiazol- 4- yl)- 5- methyl- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: Cc1n[nH]c(=S)n1c1cccc2c1non2

STK629857
Synonyms: (4Z)- 4- (3,5- dichloro- 4- methoxybenzylidene)- 5- hydroxy- 2- phenyl- 2,4- dihydro- 3H- pyrazol- 3- one
Smiles: COc1c(Cl)cc(cc1Cl)/C=C\1/C(=NN(C1=O)c1ccccc1)O

STK629859
Synonyms: N- [(2Z)- 2- (propanoylimino)- 4- (thiophen- 2- yl)- 2,3- dihydro- 1,3- thiazol- 5- yl]furan- 2- carboxamide
Smiles: CCC(=O)/N=c/1\sc(c([nH]1)c1cccs1)NC(=O)c1ccco1

STK629863
Synonyms: N- [3- (5- ethyl- 1,3- benzoxazol- 2- yl)- 4- hydroxyphenyl]- 2- methylpropanamide
Smiles: CCc1ccc2c(c1)nc(o2)c1cc(ccc1O)NC(=O)C(C)C

STK629864
Synonyms: N- (1,3- benzodioxol- 5- yl)- 7- hydroxy- 5- methyl[1,2,4]triazolo[1,5- a]pyrimidine- 2- carboxamide
Smiles: Cc1cc(O)n2c(n1)nc(n2)C(=O)Nc1ccc2c(c1)OCO2

STK629867
Synonyms: 4- (1H- benzimidazol- 2- yl)- 1- {[(E)- (2,6- dichlorophenyl)methylidene]amino}- 5- imino- 2,5- dihydro- 1H- pyrrol- 3- ol
Smiles: Clc1cccc(c1/C=N/N1CC(=C(C1=N)c1nc2c([nH]1)cccc2)O)Cl

STK629869
Synonyms: (5Z)- 3- (4- hydroxyphenyl)- 5- (quinolin- 8- ylmethylidene)- 2- thioxo- 1,3- thiazolidin- 4- one
Smiles: Oc1ccc(cc1)N1C(=S)S/C(=C\c2cccc3c2nccc3)/C1=O

STK629872
Synonyms: 1- (2- chloro- 7H- purin- 6- yl)- N- (2,2- dimethoxyethyl)piperidine- 4- carboxamide
Smiles: COC(CNC(=O)C1CCN(CC1)c1nc(Cl)nc2c1[nH]cn2)OC

STK629874
Synonyms: 2- phenyl- 6- [(4- phenylpiperazin- 1- yl)carbonyl]- 4,5- dihydropyridazin- 3(2H)- one
Smiles: O=C1CCC(=NN1c1ccccc1)C(=O)N1CCN(CC1)c1ccccc1

STK629875
Synonyms: trans- N- {2- oxo- 2- [(2- phenylethyl)amino]ethyl}- 4- {[(phenylsulfonyl)amino]methyl}cyclohexanecarboxamide
Smiles: O=C(CNC(=O)[C@@H]1CC[C@H](CC1)CNS(=O)(=O)c1ccccc1)NCCc1ccccc1

STK629876
Synonyms: trans- N- {2- [benzyl(methyl)amino]- 2- oxoethyl}- 4- ({[(4- chlorophenyl)sulfonyl]amino}methyl)cyclohexanecarboxamide
Smiles: O=C([C@@H]1CC[C@H](CC1)CNS(=O)(=O)c1ccc(cc1)Cl)NCC(=O)N(Cc1ccccc1)C

STK629878
Synonyms: N- (2- chlorophenyl)- 2- {[3- (4- methoxyphenyl)- 4- oxo- 4H- chromen- 7- yl]oxy}acetamide
Smiles: COc1ccc(cc1)c1coc2c(c1=O)ccc(c2)OCC(=O)Nc1ccccc1Cl

STK629879
Synonyms: (2E)- 2- [(1- ethyl- 1H- indol- 3- yl)methylidene]- 6- [(2- fluorobenzyl)oxy]- 1- benzofuran- 3(2H)- one
Smiles: CCn1cc(c2c1cccc2)/C=C\1/Oc2c(C1=O)ccc(c2)OCc1ccccc1F

STK857089
Synonyms: ethyl3- (2- methoxyphenyl)- 7- {[(2- methoxyphenyl)carbonyl]oxy}- 4- oxo- 4H- chromene- 2- carboxylate
Smiles: CCOC(=O)c1oc2cc(ccc2c(=O)c1c1ccccc1OC)OC(=O)c1ccccc1OC

STK629881
Synonyms: 7- (5- bromopyridin- 2- yl)- 2- (4- methoxyphenyl)- 8,9- dimethyl- 7H- pyrrolo[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: COc1ccc(cc1)c1nn2c(n1)c1c(nc2)n(c(c1C)C)c1ccc(cn1)Br

STK629882
Synonyms: 2- (3- chlorophenyl)- 4- (2,3- dihydro- 1,4- benzodioxin- 6- ylsulfonyl)- N- (2- methoxyethyl)- 1,3- oxazol- 5- amine
Smiles: COCCNc1oc(nc1S(=O)(=O)c1ccc2c(c1)OCCO2)c1cccc(c1)Cl

STK857090
Synonyms: 3- ethyl6- methyl4- (2,3- dihydro- 1,4- benzodioxin- 6- ylamino)quinoline- 3,6- dicarboxylate
Smiles: CCOC(=O)c1cnc2c(c1Nc1ccc3c(c1)OCCO3)cc(cc2)C(=O)OC

STK629885
Synonyms: ethyl3,5- dimethyl- 1- (4- nitrobenzyl)- 2,4- dioxo- 1,2,3,4- tetrahydrothieno[2,3- d]pyrimidine- 6- carboxylate
Smiles: CCOC(=O)c1sc2c(c1C)c(=O)n(c(=O)n2Cc1ccc(cc1)[N+](=O)[O-])C

STK629887
Synonyms: {[3- (4- methoxyphenoxy)- 4- oxo- 4H- chromen- 7- yl]oxy}aceticacid
Smiles: COc1ccc(cc1)Oc1coc2c(c1=O)ccc(c2)OCC(=O)O

STK629889
Synonyms: 1- [(4- hydroxyphthalazin- 1- yl)acetyl]piperidine- 4- carboxamide
Smiles: NC(=O)C1CCN(CC1)C(=O)Cc1nnc(c2c1cccc2)O

STK629890
Synonyms: propan- 2- yl({(2E)- 2- [(1- ethyl- 1H- indol- 3- yl)methylidene]- 7- methyl- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl}oxy)acetate
Smiles: CCn1cc(c2c1cccc2)/C=C\1/Oc2c(C1=O)ccc(c2C)OCC(=O)OC(C)C

STK629893
Synonyms: 6'- methyl- 3',4'- dihydro- 8'H- spiro[cyclohexane- 1,2'- pyrano[3,2- g]chromene]- 8'- thione
Smiles: S=c1cc(C)c2c(o1)cc1c(c2)CCC2(O1)CCCCC2

STK629894
Synonyms: 3- [(1,3- dimethyl- 2,4,6- trioxotetrahydropyrimidin- 5(2H)- ylidene)methyl]- N,N- dimethyl- 1H- indole- 1- sulfonamide
Smiles: O=C1N(C)C(=O)C(=Cc2cn(c3c2cccc3)S(=O)(=O)N(C)C)C(=O)N1C

STK629895
Synonyms: N- {2- [4- (1,3- benzothiazol- 2- yl)piperidin- 1- yl]- 2- oxoethyl}- 2- (4- hydroxyphthalazin- 1- yl)acetamide
Smiles: O=C(Cc1nnc(c2c1cccc2)O)NCC(=O)N1CCC(CC1)c1nc2c(s1)cccc2

STK629898
Synonyms: 2- {1- [7- (furan- 2- ylmethyl)- 8,9- dimethyl- 7H- pyrrolo[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 2- yl]- 3- methylbutyl}- 1H- isoindole- 1,3(2H)- dione
Smiles: CC(CC(N1C(=O)c2c(C1=O)cccc2)c1nc2n(n1)cnc1c2c(C)c(n1Cc1ccco1)C)C

STK629906
Synonyms: 4- methoxy- N,N- dimethyl- 6- {3- [(2- phenoxyethyl)sulfanyl]- 1H- 1,2,4- triazol- 1- yl}- 1,3,5- triazin- 2- amine
Smiles: COc1nc(nc(n1)N(C)C)n1cnc(n1)SCCOc1ccccc1

STK857095
Synonyms: 3- (3,4- dihydro- 2H- 1,5- benzodioxepin- 7- yl)- 6- ethyl- 4- oxo- 4H- chromen- 7- ylmorpholine- 4- carboxylate
Smiles: CCc1cc2c(cc1OC(=O)N1CCOCC1)occ(c2=O)c1ccc2c(c1)OCCCO2

STK629910
Synonyms: (2E)- 2- [(1- ethyl- 1H- indol- 3- yl)methylidene]- 7- methyl- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl2- methylbenzoate
Smiles: CCn1cc(c2c1cccc2)/C=C\1/Oc2c(C1=O)ccc(c2C)OC(=O)c1ccccc1C

STK629912
Synonyms: (2Z)- 8- (4- methoxyphenyl)- 2- (2,3,4- trimethoxybenzylidene)- 8,9- dihydro- 7H- furo[2,3- f][1,3]benzoxazin- 3(2H)- one
Smiles: COc1ccc(cc1)N1COc2c(C1)c1O/C(=C\c3ccc(c(c3OC)OC)OC)/C(=O)c1cc2

STK629913
Synonyms: N~3~- pyrimidin- 2- yl- N- (3,4,5- trimethoxyphenyl)- beta- alaninamide
Smiles: COc1cc(NC(=O)CCNc2ncccn2)cc(c1OC)OC

STK629914
Synonyms: 7- [(2- chlorobenzyl)oxy]- 3- (2- methoxyphenyl)- 2- methyl- 4H- chromen- 4- one
Smiles: COc1ccccc1c1c(C)oc2c(c1=O)ccc(c2)OCc1ccccc1Cl

STK629917
Synonyms: N- (butan- 2- yl)- 8,9- dimethylthieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 5- amine
Smiles: CCC(Nc1nc2sc(c(c2c2n1ncn2)C)C)C

STK629919
Synonyms: 6- chloro- 4- methyl- 3- [2- (4- methylpiperazin- 1- yl)- 2- oxoethyl]- 7- [(2- methylprop- 2- en- 1- yl)oxy]- 2H- chromen- 2- one
Smiles: CC(=C)COc1cc2oc(=O)c(c(c2cc1Cl)C)CC(=O)N1CCN(CC1)C

STK629922
Synonyms: 7- [2- (3,4- dihydroisoquinolin- 2(1H)- yl)- 2- oxoethoxy]- 3- phenyl- 4H- chromen- 4- one
Smiles: O=C(N1CCc2c(C1)cccc2)COc1ccc2c(c1)occ(c2=O)c1ccccc1

STK629923
Synonyms: 5- (furan- 2- yl)- 2- hydroxy- 1- (2- phenylethyl)pyrido[2,3- d]pyrimidin- 4(1H)- one
Smiles: O=c1nc(O)n(c2c1c(ccn2)c1ccco1)CCc1ccccc1

STK629926
Synonyms: ethyl2- [(2,4- dichlorophenyl)amino]- 4- hydroxypyrimidine- 5- carboxylate
Smiles: CCOC(=O)c1cnc(nc1O)Nc1ccc(cc1Cl)Cl

STK629927
Synonyms: 7- {2- oxo- 2- [4- (pyrimidin- 2- yl)piperazin- 1- yl]ethoxy}- 3- phenyl- 4H- chromen- 4- one
Smiles: O=C(N1CCN(CC1)c1ncccn1)COc1ccc2c(c1)occ(c2=O)c1ccccc1

STK629928
Synonyms: 4- (1,3- benzoxazol- 2- yl)- N- phenylpiperidine- 1- carboxamide
Smiles: O=C(N1CCC(CC1)c1nc2c(o1)cccc2)Nc1ccccc1

STK629929
Synonyms: 2- hydroxy- 5- (naphthalen- 1- yl)pyrido[2,3- d]pyrimidin- 4(1H)- one
Smiles: Oc1nc(=O)c2c([nH]1)nccc2c1cccc2c1cccc2

STK629930
Synonyms: (2Z)- 2- (2- bromobenzylidene)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl2,2- dimethylpropanoate
Smiles: O=C(C(C)(C)C)Oc1ccc2c(c1)O/C(=C\c1ccccc1Br)/C2=O

STK629931
Synonyms: 5- (furan- 2- yl)- 2- hydroxy- 1- propylpyrido[2,3- d]pyrimidin- 4(1H)- one
Smiles: CCCn1c(O)nc(=O)c2c1nccc2c1ccco1

STK629932
Synonyms: [(5E)- 4- oxo- 5- (quinolin- 6- ylmethylidene)- 2- thioxo- 1,3- thiazolidin- 3- yl](phenyl)aceticacid
Smiles: S=C1S/C(=C/c2ccc3c(c2)cccn3)/C(=O)N1C(c1ccccc1)C(=O)O

STK629933
Synonyms: 4- [(3Z)- 3- (1- methyl- 2- oxo- 1,2- dihydro- 3H- indol- 3- ylidene)- 2,5- dioxopyrrolidin- 1- yl]phenylacetate
Smiles: CC(=O)Oc1ccc(cc1)N1C(=O)C/C(=C\2/C(=O)N(c3c2cccc3)C)/C1=O

STK629935
Synonyms: N- (3- chlorophenyl)- 4- (4- methoxyphenyl)- 1- phenyl- 5,6,7,8- tetrahydro- 2a,4a- diazacyclopenta[cd]azulene- 2- carboxamide
Smiles: COc1ccc(cc1)c1cn2c3n1CCCCc3c(c2C(=O)Nc1cccc(c1)Cl)c1ccccc1

STK629937
Synonyms: 3- [(4- chlorophenoxy)methyl]- 6- [5- (2- methylpropyl)- 1H- pyrazol- 3- yl][1,2,4]triazolo[3,4- b][1,3,4]thiadiazole
Smiles: CC(Cc1[nH]nc(c1)c1nn2c(s1)nnc2COc1ccc(cc1)Cl)C

STK857099
Synonyms: 5- ethoxy- 4- oxo- 2- phenyl- 4H- chromen- 7- yldimethylcarbamate
Smiles: CCOc1cc(OC(=O)N(C)C)cc2c1c(=O)cc(o2)c1ccccc1

STK629939
Synonyms: 4- (3- chlorobenzyl)- 2- (2- methoxyphenyl)- 5- methyl- 1,2- dihydro- 3H- pyrazol- 3- one
Smiles: COc1ccccc1n1[nH]c(c(c1=O)Cc1cccc(c1)Cl)C

STK857100
Synonyms: 6- (4- ethoxyphenyl)- 8- hydroxy- 1,3- dimethyl- 4H- cyclohepta[c]furan- 4- one
Smiles: CCOc1ccc(cc1)c1cc(=O)c2c(c(c1)O)c(oc2C)C

STK629940
Synonyms: 3- (4- fluorophenyl)- 2- methyl- 5- {[(1- phenyl- 1H- tetrazol- 5- yl)sulfanyl]methyl}pyrazolo[1,5- a]pyrimidin- 7- ol
Smiles: Fc1ccc(cc1)c1c(C)nn2c1nc(CSc1nnnn1c1ccccc1)cc2O

STK857102
Synonyms: 4- oxo- 3- phenyl- 4H- chromen- 7- ylpropanoate
Smiles: CCC(=O)Oc1ccc2c(c1)occ(c2=O)c1ccccc1

STK629943
Synonyms: 6- (2- phosphonophenoxy)hexanoicacid
Smiles: OC(=O)CCCCCOc1ccccc1P(=O)(O)O

STK629945
Synonyms: 2- [(1'- acetyl- 4- oxo- 3,4- dihydrospiro[chromene- 2,4'- piperidin]- 7- yl)oxy]- N- (3- methylbutyl)acetamide
Smiles: CC(CCNC(=O)COc1ccc2c(c1)OC1(CC2=O)CCN(CC1)C(=O)C)C

STK629946
Synonyms: 2- [4- (2- methoxyphenyl)piperazin- 1- yl]- 6- methyl- 5- (3- methylbutyl)pyrimidin- 4- ol
Smiles: COc1ccccc1N1CCN(CC1)c1nc(C)c(c(n1)O)CCC(C)C

STK629948
Synonyms: 3- (3,4- difluorophenyl)- 2- phenyl- 2,3- dihydroquinazolin- 4(1H)- one
Smiles: O=C1c2ccccc2NC(N1c1ccc(c(c1)F)F)c1ccccc1

STK629953
Synonyms: 1- [4- (2,3- dihydro- 1,4- benzodioxin- 6- ylsulfonyl)- 2- (2- methylphenyl)- 1,3- oxazol- 5- yl]- 4- methylpiperazine
Smiles: CN1CCN(CC1)c1oc(nc1S(=O)(=O)c1ccc2c(c1)OCCO2)c1ccccc1C

STK629954
Synonyms: 4- (2,3- dihydro- 1,4- benzodioxin- 6- ylsulfonyl)- 2- (furan- 2- yl)- N,N- dimethyl- 1,3- oxazol- 5- amine
Smiles: CN(c1oc(nc1S(=O)(=O)c1ccc2c(c1)OCCO2)c1ccco1)C

STK629955
Synonyms: N- {2- [(4- oxo- 1,2,3,4- tetrahydrocyclopenta[c]chromen- 7- yl)oxy]propanoyl}- beta- alanine
Smiles: OC(=O)CCNC(=O)C(Oc1ccc2c(c1)oc(=O)c1c2CCC1)C

STK629957
Synonyms: 2- (7- hydroxy- 4- methyl- 2- oxo- 2H- chromen- 3- yl)- N- (4- methoxyphenyl)acetamide
Smiles: COc1ccc(cc1)NC(=O)Cc1c(=O)oc2c(c1C)ccc(c2)O

STK629958
Synonyms: 2- [4- (4- cyano- 1- methyl- 5,6,7,8- tetrahydroisoquinolin- 3- yl)piperazin- 1- yl]- 2- oxoacetamide
Smiles: N#Cc1c(nc(c2c1CCCC2)C)N1CCN(CC1)C(=O)C(=O)N

STK629962
Synonyms: 3,3,5,5- tetramethyl- N- phenyl- 1,3,4,5- tetrahydro- 2H- 2- benzazepine- 2- carboxamide
Smiles: O=C(N1Cc2ccccc2C(CC1(C)C)(C)C)Nc1ccccc1

STK629967
Synonyms: N- [2- (4- methylpiperazin- 1- yl)- 2- oxoethyl]- 3- phenyl- 2,1- benzoxazole- 5- carboxamide
Smiles: CN1CCN(CC1)C(=O)CNC(=O)c1ccc2c(c1)c(on2)c1ccccc1

STK629971
Synonyms: N- [2- (azepan- 1- ylsulfonyl)ethyl]- 3- (3- chloro- 1,2- oxazol- 5- yl)- N- (pyridin- 3- ylmethyl)propanamide
Smiles: O=C(N(Cc1cccnc1)CCS(=O)(=O)N1CCCCCC1)CCc1onc(c1)Cl

STK629972
Synonyms: 1- (9H- purin- 6- yl)- N- (pyridin- 3- yl)piperidine- 4- carboxamide
Smiles: O=C(C1CCN(CC1)c1ncnc2c1nc[nH]2)Nc1cccnc1

STK629973
Synonyms: 1- (1,1- dioxidotetrahydrothiophen- 3- yl)- N- (4- methoxyphenyl)- 4,5,6,7- tetrahydro- 1H- indazole- 3- carboxamide
Smiles: COc1ccc(cc1)NC(=O)c1nn(c2c1CCCC2)C1CCS(=O)(=O)C1

STK629975
Synonyms: 5- (3- tert- butyl- 1H- pyrazol- 5- yl)- 4- (pyridin- 3- yl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: S=c1[nH]nc(n1c1cccnc1)c1[nH]nc(c1)C(C)(C)C

STK629976
Synonyms: 2- ({2- [(5E)- 5- benzylidene- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]propanoyl}amino)- 5- hydroxybenzoicacid
Smiles: O=C(C(N1C(=S)S/C(=C/c2ccccc2)/C1=O)C)Nc1ccc(cc1C(=O)O)O

STK629979
Synonyms: N- [2- (5- fluoro- 1H- indol- 3- yl)ethyl]- N~3~- (5- nitropyridin- 2- yl)- beta- alaninamide
Smiles: O=C(CCNc1ccc(cn1)[N+](=O)[O-])NCCc1c[nH]c2c1cc(F)cc2

STK629980
Synonyms: 1- (thiophen- 2- ylsulfonyl)- N- [3- (trifluoromethyl)phenyl]prolinamide
Smiles: O=C(C1CCCN1S(=O)(=O)c1cccs1)Nc1cccc(c1)C(F)(F)F

STK629981
Synonyms: 5- methyl- 4- (3- methylbutyl)- 2- (4- methylphenyl)- 1,2- dihydro- 3H- pyrazol- 3- one
Smiles: CC(CCc1c(C)[nH]n(c1=O)c1ccc(cc1)C)C

STK629982
Synonyms: 3- (4- methoxyphenoxy)- 2- methyl- 7- [2- (4- methylpiperazin- 1- yl)- 2- oxoethoxy]- 4H- chromen- 4- one
Smiles: COc1ccc(cc1)Oc1c(C)oc2c(c1=O)ccc(c2)OCC(=O)N1CCN(CC1)C

STK629987
Synonyms: N- [3- (diethylamino)propyl]- 1- (7H- purin- 6- yl)piperidine- 3- carboxamide
Smiles: CCN(CCCNC(=O)C1CCCN(C1)c1ncnc2c1[nH]cn2)CC

STK629988
Synonyms: 2- ethyl- 3- (morpholin- 4- ylcarbonyl)- 1,1- dioxido- 2H- 1,2- benzothiazin- 4- ylbenzoate
Smiles: CCN1C(=C(OC(=O)c2ccccc2)c2c(S1(=O)=O)cccc2)C(=O)N1CCOCC1

STK629990
Synonyms: methyl3- (2- hydroxy- 4- oxoquinazolin- 3(4H)- yl)propanoate
Smiles: COC(=O)CCn1c(O)nc2c(c1=O)cccc2

STK629991
Synonyms: 2,6- dihydroxypyrimidine- 4- carboxylicacid
Smiles: Oc1nc(O)nc(c1)C(=O)O

STK629998
Synonyms:
Smiles: CCC([C@@H](C(=O)O)NC(=O)N1CCC(CC1)c1nc2c([nH]1)cccc2)C

STK629999
Synonyms: 2- hydroxy- N- {(5Z)- 5- [(1- methyl- 1,2,3,4- tetrahydroquinolin- 6- yl)methylidene]- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl}benzamide
Smiles: S=C1S/C(=C\c2ccc3c(c2)CCCN3C)/C(=O)N1NC(=O)c1ccccc1O

STK630000
Synonyms: 2- [(2- benzyl- 7,8- dihydro- 6H- thiopyrano[3,2- d]pyrimidin- 4- yl)amino]ethanol
Smiles: OCCNc1nc(Cc2ccccc2)nc2c1SCCC2

STK630002
Synonyms: 5- amino- N- (3- bromophenyl)- 1- (2- methoxyphenyl)- 1H- 1,2,3- triazole- 4- carboxamide
Smiles: COc1ccccc1n1nnc(c1N)C(=O)Nc1cccc(c1)Br

STK630003
Synonyms: 3- {[1- (4- chlorophenyl)- 1H- tetrazol- 5- yl]methoxy}benzoicacid
Smiles: Clc1ccc(cc1)n1nnnc1COc1cccc(c1)C(=O)O

STK630004
Synonyms: 3- (3,4- dimethoxyphenyl)- 9- [2- (thiophen- 2- yl)ethyl]- 9,10- dihydro- 4H,8H- chromeno[8,7- e][1,3]oxazin- 4- one
Smiles: COc1cc(ccc1OC)c1coc2c(c1=O)ccc1c2CN(CO1)CCc1cccs1

STK630006
Synonyms: (2Z)- 2- (3,4- dichlorobenzylidene)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl4- chlorobenzenesulfonate
Smiles: Clc1ccc(cc1)S(=O)(=O)Oc1ccc2c(c1)O/C(=C\c1ccc(c(c1)Cl)Cl)/C2=O

STK630007
Synonyms: 5- amino- 2- (2- chlorophenyl)- 4- methyl- N- (1,3- thiazol- 2- yl)thieno[2,3- d]pyrimidine- 6- carboxamide
Smiles: O=C(c1sc2c(c1N)c(C)nc(n2)c1ccccc1Cl)Nc1nccs1

STK630012
Synonyms: N- [1- (2,4- dichlorobenzyl)- 3,5- dimethyl- 1H- pyrazol- 4- yl]- N'- [(1,3,5- trimethyl- 1H- pyrazol- 4- yl)methyl]ethanediamide
Smiles: Clc1ccc(c(c1)Cl)Cn1nc(c(c1C)NC(=O)C(=O)NCc1c(C)nn(c1C)C)C

STK630014
Synonyms: 3- [(5E)- 4- oxo- 5- (thiophen- 2- ylmethylidene)- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- (quinoxalin- 6- yl)propanamide
Smiles: O=C(Nc1ccc2c(c1)nccn2)CCN1C(=S)S/C(=C/c2cccs2)/C1=O

STK630020
Synonyms: (2Z)- 2- (2- chloro- 6- fluorobenzylidene)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl2,2- dimethylpropanoate
Smiles: O=C1/C(=C/c2c(F)cccc2Cl)/Oc2c1ccc(c2)OC(=O)C(C)(C)C

STK630021
Synonyms: N- [3- (dimethylamino)propyl]- N'- (2- phenyl- 1H- indol- 3- yl)ethanediamide
Smiles: CN(CCCNC(=O)C(=O)Nc1c([nH]c2c1cccc2)c1ccccc1)C

STK630022
Synonyms: 5- [2- (3,4- dimethoxyphenyl)- 2- oxoethyl]- 2,5,6- trihydroxypyrimidin- 4(5H)- one
Smiles: COc1ccc(cc1OC)C(=O)CC1(O)C(=NC(=NC1=O)O)O

STK857103
Synonyms: (2Z)- 2- (2- ethoxybenzylidene)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- ylacetate
Smiles: CCOc1ccccc1/C=C/1\Oc2c(C1=O)ccc(c2)OC(=O)C

STK630030
Synonyms: 3- cyano- N- (2- methoxyphenyl)- 5- methyl- 7- (thiophen- 2- yl)- 1,7- dihydropyrazolo[1,5- a]pyrimidine- 6- carboxamide
Smiles: COc1ccccc1NC(=O)C1=C(C)N=c2n(C1c1cccs1)[nH]cc2C#N

STK630031
Synonyms: 3- (4- chlorophenyl)- 9- [2- (morpholin- 4- yl)ethyl]- 9,10- dihydro- 4H,8H- chromeno[8,7- e][1,3]oxazin- 4- one
Smiles: Clc1ccc(cc1)c1coc2c(c1=O)ccc1c2CN(CCN2CCOCC2)CO1

STK630034
Synonyms: N- (prop- 2- en- 1- yl)- 1- (9H- purin- 6- yl)piperidine- 4- carboxamide
Smiles: C=CCNC(=O)C1CCN(CC1)c1ncnc2c1nc[nH]2

STK630035
Synonyms: (2Z)- 2- (furan- 2- ylmethylidene)- 8- [2- (4- methoxyphenyl)ethyl]- 8,9- dihydro- 7H- furo[2,3- f][1,3]benzoxazin- 3(2H)- one
Smiles: COc1ccc(cc1)CCN1COc2c(C1)c1O/C(=C\c3ccco3)/C(=O)c1cc2

STK630036
Synonyms: 7- (2,4- difluorophenyl)thieno[2,3- b:4,5- b']dipyridine- 2,4- diol
Smiles: Fc1ccc(c(c1)F)c1ccc2c(n1)sc1c2nc(cc1O)O

STK630040
Synonyms: 2- [(2- oxo- 2H- chromen- 7- yl)oxy]- N- [2- (3- phenyl- 1,2,4- oxadiazol- 5- yl)ethyl]acetamide
Smiles: O=C(COc1ccc2c(c1)oc(=O)cc2)NCCc1onc(n1)c1ccccc1

STK630042
Synonyms: N- (3- chlorophenyl)- 2- [(2- chloro- 7H- purin- 6- yl)sulfanyl]acetamide
Smiles: O=C(Nc1cccc(c1)Cl)CSc1nc(Cl)nc2c1[nH]cn2

STK630044
Synonyms: N- (4- methoxyphenyl)- 2- [(2- oxo- 4- propyl- 2H- chromen- 7- yl)oxy]acetamide
Smiles: CCCc1cc(=O)oc2c1ccc(c2)OCC(=O)Nc1ccc(cc1)OC

STK630045
Synonyms: (4- methylpiperazin- 1- yl)[5- methyl- 7- (pyridin- 3- yl)- 3,7- dihydro[1,2,4]triazolo[1,5- a]pyrimidin- 6- yl]methanone
Smiles: CN1CCN(CC1)C(=O)C1=C(C)N=c2n(C1c1cccnc1)nc[nH]2

STK630048
Synonyms: (2Z)- 8- (2- methoxybenzyl)- 2- (pyridin- 3- ylmethylidene)- 8,9- dihydro- 7H- furo[2,3- f][1,3]benzoxazin- 3(2H)- one
Smiles: COc1ccccc1CN1COc2c(C1)c1O/C(=C\c3cccnc3)/C(=O)c1cc2

STK630053
Synonyms: 3- (3- cyclohexyl[1,2,4]triazolo[3,4- b][1,3,4]thiadiazol- 6- yl)- 1H- indole
Smiles: C1CCC(CC1)c1nnc2n1nc(s2)c1c[nH]c2c1cccc2

STK857105
Synonyms: (2Z)- 2- [(6- chloro- 4H- 1,3- benzodioxin- 8- yl)methylidene]- 7- [(diethylammonio)methyl]- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- olate
Smiles: CC[NH+](Cc1c([O-])ccc2c1O/C(=C\c1cc(Cl)cc3c1OCOC3)/C2=O)CC

STK630054
Synonyms: 4- [(Z)- (2,4- dioxo- 1,3- thiazolidin- 5- ylidene)methyl]- N- (2- oxo- 2H- chromen- 6- yl)benzamide
Smiles: O=C1NC(=O)/C(=C/c2ccc(cc2)C(=O)Nc2ccc3c(c2)ccc(=O)o3)/S1

STK630055
Synonyms: (2Z)- 2- (1- benzofuran- 2- ylmethylidene)- 7- [(3,5- dimethylpiperidinium- 1- yl)methyl]- 4- methyl- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- olate
Smiles: CC1CC(C)C[NH+](C1)Cc1c([O-])cc(c2c1O/C(=C\c1cc3c(o1)cccc3)/C2=O)C

STK630060
Synonyms: 3- [(5E)- 4- oxo- 5- (quinolin- 2- ylmethylidene)- 2- thioxo- 1,3- thiazolidin- 3- yl]benzoicacid
Smiles: S=C1S/C(=C/c2ccc3c(n2)cccc3)/C(=O)N1c1cccc(c1)C(=O)O

STK630062
Synonyms: [4- (4- chlorophenyl)- 4- hydroxypiperidin- 1- yl][4- methyl- 2- (4- methylphenyl)- 1,3- thiazol- 5- yl]methanone
Smiles: Cc1ccc(cc1)c1sc(c(n1)C)C(=O)N1CCC(CC1)(O)c1ccc(cc1)Cl

STK630065
Synonyms: 1- (4- hydroxy- 6,7- dihydro- 5H- cyclopenta[d]pyrimidin- 2- yl)- 3- (4- methoxyphenyl)guanidine
Smiles: COc1ccc(cc1)NC(=N)Nc1nc(O)c2c(n1)CCC2

STK630066
Synonyms: 5- hydroxy- 7- (2- oxo- 2- {4- [2- (pyridin- 2- yl)ethyl]piperazin- 1- yl}ethoxy)- 2- phenyl- 4H- chromen- 4- one
Smiles: O=C(N1CCN(CC1)CCc1ccccn1)COc1cc(O)c2c(c1)oc(cc2=O)c1ccccc1

STK630067
Synonyms: 3- [(5Z)- 5- (4- chlorobenzylidene)- 2,4- dioxo- 1,3- thiazolidin- 3- yl]- N- [3- (1H- imidazol- 1- yl)propyl]propanamide
Smiles: O=C(CCN1C(=O)S/C(=C\c2ccc(cc2)Cl)/C1=O)NCCCn1ccnc1

STK630072
Synonyms: 1- benzyl- 2- hydroxy- 5- (2- methylphenyl)pyrido[2,3- d]pyrimidin- 4(1H)- one
Smiles: Cc1ccccc1c1ccnc2c1c(=O)nc(n2Cc1ccccc1)O

STK630073
Synonyms: N- (2- chlorophenyl)- 2- (3,4- dimethoxyphenyl)- 6,7- dihydro[1,3]thiazolo[5,4- c]pyridine- 5(4H)- carbothioamide
Smiles: COc1cc(ccc1OC)c1nc2c(s1)CN(CC2)C(=S)Nc1ccccc1Cl

STK630074
Synonyms: N- [(1,3- dimethyl- 2,6- dioxo- 1,2,3,6- tetrahydropyrimidin- 4- yl)methyl]- beta- alaninamide
Smiles: NCCC(=O)NCc1cc(=O)n(c(=O)n1C)C

STK630081
Synonyms: 8- ethoxy- 1,3- dimethyl- 2- (quinolin- 8- yl)cyclohepta[c]pyrrol- 4(2H)- one
Smiles: CCOc1cccc(=O)c2c1c(C)n(c2C)c1cccc2c1nccc2

STK630082
Synonyms: N- [(5E)- 4- oxo- 5- (quinoxalin- 6- ylmethylidene)- 2- thioxo- 1,3- thiazolidin- 3- yl]pyridine- 3- carboxamide
Smiles: O=C(c1cccnc1)NN1C(=S)S/C(=C/c2ccc3c(c2)nccn3)/C1=O

STK630083
Synonyms: N- [3- cyano- 4,5- dimethyl- 1- (pyridin- 3- yl)- 1H- pyrrol- 2- yl]- 2- (4- methoxyphenyl)acetamide
Smiles: COc1ccc(cc1)CC(=O)Nc1n(c2cccnc2)c(c(c1C#N)C)C

STK630094
Synonyms: N- [2- oxo- 2- (quinolin- 5- ylamino)ethyl]- 1- (phenylsulfonyl)piperidine- 3- carboxamide
Smiles: O=C(Nc1cccc2c1cccn2)CNC(=O)C1CCCN(C1)S(=O)(=O)c1ccccc1

STK630098
Synonyms: 2- (3- methoxyphenyl)- 4,5,6,7- tetrahydro[1,3]thiazolo[5,4- c]pyridine
Smiles: COc1cccc(c1)c1nc2c(s1)CNCC2

STK630105
Synonyms: N- (4,6- dimethyl- 1H- pyrazolo[3,4- b]pyridin- 3- yl)- N'- (2- hydroxy- 2- phenylethyl)ethanediamide
Smiles: Cc1cc(C)c2c(n1)[nH]nc2NC(=O)C(=O)NCC(c1ccccc1)O

STK630106
Synonyms: ethyl1- {[5- (4,4- dimethyl- 1,1- dioxido- 3- oxo- 1,2- thiazolidin- 2- yl)- 2- methoxyphenyl]sulfonyl}piperidine- 4- carboxylate
Smiles: CCOC(=O)C1CCN(CC1)S(=O)(=O)c1cc(ccc1OC)N1C(=O)C(CS1(=O)=O)(C)C

STK630109
Synonyms: (1Z)- N- {[8,9- dimethyl- 7- (pyridin- 2- ylmethyl)- 7H- pyrrolo[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 2- yl]methoxy}- 1- (4- methoxyphenyl)ethanimine
Smiles: COc1ccc(cc1)/C(=N\OCc1nn2c(n1)c1c(nc2)n(c(c1C)C)Cc1ccccn1)/C

STK630111
Synonyms: N- [(3- phenyl- 1,2,4- oxadiazol- 5- yl)methyl]- N~3~- pyrimidin- 2- yl- beta- alaninamide
Smiles: O=C(NCc1onc(n1)c1ccccc1)CCNc1ncccn1

STK857111
Synonyms: butyl{[3- (2- methoxyphenyl)- 4- oxo- 4H- chromen- 7- yl]oxy}acetate
Smiles: CCCCOC(=O)COc1ccc2c(c1)occ(c2=O)c1ccccc1OC

STK630115
Synonyms: 8,9- dimethyl- 7- (4- methylpyridin- 2- yl)- 2- (thiophen- 2- yl)- 7H- pyrrolo[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: Cc1ccnc(c1)n1c(C)c(c2c1ncn1c2nc(n1)c1cccs1)C

STK630116
Synonyms: (2Z)- 2- (2- bromobenzylidene)- 8- (pyridin- 4- ylmethyl)- 8,9- dihydro- 7H- furo[2,3- f][1,3]benzoxazin- 3(2H)- one
Smiles: O=C1/C(=C/c2ccccc2Br)/Oc2c1ccc1c2CN(CO1)Cc1ccncc1

STK630117
Synonyms: 4- (3- cyano- 4,6- dimethyl- 2- oxopyridin- 1(2H)- yl)- N- (thiophen- 2- ylmethyl)benzamide
Smiles: N#Cc1c(C)cc(n(c1=O)c1ccc(cc1)C(=O)NCc1cccs1)C

STK630124
Synonyms: 4- {[2- (thiophen- 2- yl)ethyl]amino}tetrahydrothiophene- 3- ol1,1- dioxide
Smiles: OC1CS(=O)(=O)CC1NCCc1cccs1

STK630125
Synonyms: 7- [2- (4- acetylpiperazin- 1- yl)- 2- oxoethoxy]- 5- hydroxy- 2,2- dimethyl- 2,3- dihydro- 4H- chromen- 4- one
Smiles: O=C(N1CCN(CC1)C(=O)C)COc1cc(O)c2c(c1)OC(CC2=O)(C)C

STK630128
Synonyms: N- [2- chloro- 5- (8- ethoxy- 1,3- dimethyl- 4- oxocyclohepta[c]pyrrol- 2(4H)- yl)phenyl]acetamide
Smiles: CCOc1cccc(=O)c2c1c(C)n(c2C)c1ccc(c(c1)NC(=O)C)Cl

STK630131
Synonyms: 6- (4- bromobenzyl)- 3- (4- methoxyphenyl)- 2,5- dimethylpyrazolo[1,5- a]pyrimidin- 7- ol
Smiles: COc1ccc(cc1)c1c(C)nn2c1nc(C)c(c2O)Cc1ccc(cc1)Br

STK630136
Synonyms: (3Z)- 3- (1,3- benzodioxol- 5- ylmethylidene)- 2,3- dihydro- 4H- 1,2- benzothiazin- 4- one1,1- dioxide
Smiles: O=C1/C(=C/c2ccc3c(c2)OCO3)/NS(=O)(=O)c2c1cccc2

STK630142
Synonyms: (2Z)- 2- (3- fluorobenzylidene)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl4- chlorobenzenesulfonate
Smiles: Clc1ccc(cc1)S(=O)(=O)Oc1ccc2c(c1)O/C(=C\c1cccc(c1)F)/C2=O

STK630143
Synonyms: 6- (4- methylpiperazin- 1- yl)- 7H- purine
Smiles: CN1CCN(CC1)c1ncnc2c1[nH]cn2

STK630148
Synonyms: 3- [(3- methylbutyl)sulfanyl]- 6- phenyl- 1,2,4- triazin- 5- ol
Smiles: CC(CCSc1nnc(c(n1)O)c1ccccc1)C

STK630150
Synonyms: 6- (5- bromopyridin- 3- yl)- 3- cyclohexyl[1,2,4]triazolo[3,4- b][1,3,4]thiadiazole
Smiles: Brc1cncc(c1)c1nn2c(s1)nnc2C1CCCCC1

STK857112
Synonyms: 4- acetyl- 3- hydroxy- 5- (4- hydroxy- 3- methoxyphenyl)- 1- (4- hydroxyphenyl)- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: COc1cc(ccc1O)C1C(=C(C(=O)N1c1ccc(cc1)O)O)C(=O)C

STK630151
Synonyms: N- (2,5- dimethoxyphenyl)- 1- (9H- purin- 6- yl)piperidine- 4- carboxamide
Smiles: COc1ccc(cc1NC(=O)C1CCN(CC1)c1ncnc2c1nc[nH]2)OC

STK630155
Synonyms: ethyl4- [N- (2- chloro- 7H- purin- 6- yl)glycyl]piperazine- 1- carboxylate
Smiles: CCOC(=O)N1CCN(CC1)C(=O)CNc1nc(Cl)nc2c1[nH]cn2

STK630160
Synonyms: (E)- 1- [(3,5- dimethyl- 1,2- oxazol- 4- yl)sulfonyl]- N- (5- ethyl- 1,3,4- thiadiazol- 2(3H)- ylidene)prolinamide
Smiles: CCc1n[nH]/c(=N\C(=O)C2CCCN2S(=O)(=O)c2c(C)noc2C)/s1

STK630165
Synonyms: ethyl5- methoxy- 3- [(E)- (3- methyl- 4- oxo- 2- thioxo- 1,3- thiazolidin- 5- ylidene)methyl]- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1/C=C\1/SC(=S)N(C1=O)C)cc(cc2)OC

STK630167
Synonyms: 6- [5- (2- methylpropyl)- 1H- pyrazol- 3- yl]- 3- (pyridin- 3- yl)[1,2,4]triazolo[3,4- b][1,3,4]thiadiazole
Smiles: CC(Cc1[nH]nc(c1)c1nn2c(s1)nnc2c1cccnc1)C

STK630170
Synonyms: 6- benzyl- 3- (pyrazin- 2- yl)[1,2,4]triazolo[3,4- a]phthalazine
Smiles: c1ccc(cc1)Cc1nn2c(nnc2c2c1cccc2)c1cnccn1

STK630172
Synonyms: 4,4- dimethyl- 2- (3- methyl- 4- {[4- (pyridin- 2- yl)piperazin- 1- yl]sulfonyl}phenyl)- 1,2- thiazolidin- 3- one1,1- dioxide
Smiles: O=C1N(c2ccc(c(c2)C)S(=O)(=O)N2CCN(CC2)c2ccccn2)S(=O)(=O)CC1(C)C

STK630176
Synonyms: N- [2- (5- fluoro- 1H- indol- 3- yl)ethyl]- 2- {(2E)- 2- [(methylsulfonyl)imino]- 2,3- dihydro- 1,3- thiazol- 4- yl}acetamide
Smiles: O=C(Cc1cs/c(=N/S(=O)(=O)C)/[nH]1)NCCc1c[nH]c2c1cc(F)cc2

STK630179
Synonyms: (2Z)- 2- (4- methoxybenzylidene)- 8- (3,4,5- trimethoxybenzyl)- 8,9- dihydro- 7H- furo[2,3- f][1,3]benzoxazin- 3(2H)- one
Smiles: COc1ccc(cc1)/C=C/1\Oc2c(C1=O)ccc1c2CN(CO1)Cc1cc(OC)c(c(c1)OC)OC

STK630180
Synonyms: N- (1,1- dioxidotetrahydrothiophen- 3- yl)- 4- methyl- 2- (4- methylphenyl)- 1,3- thiazole- 5- carboxamide
Smiles: Cc1ccc(cc1)c1nc(c(s1)C(=O)NC1CCS(=O)(=O)C1)C

STK630181
Synonyms: 1- methyl- 1- [(4- oxo- 1,2- dihydro- 4H- pyrrolo[3,2,1- ij]quinolin- 5- yl)methyl]- 3- phenylthiourea
Smiles: CN(C(=S)Nc1ccccc1)Cc1cc2cccc3c2n(c1=O)CC3

STK630182
Synonyms: 2,3- dihydro- 1H- cyclopenta[4,5]pyrimido[1,2- a]benzimidazol- 11- ol
Smiles: Oc1c2CCCc2nc2n1c1ccccc1n2

STK857115
Synonyms: N- {2- [(4- methoxyphenyl)carbonyl]- 3- methyl- 1- benzofuran- 5- yl}pyridine- 2- carboxamide
Smiles: COc1ccc(cc1)C(=O)c1oc2c(c1C)cc(cc2)NC(=O)c1ccccn1

STK630186
Synonyms: methyl2- {4,6- dioxo- 3- [(E)- 2- phenylethenyl]- 3a,4,6,6a- tetrahydro- 5H- pyrrolo[3,4- d][1,2]oxazol- 5- yl}benzoate
Smiles: COC(=O)c1ccccc1N1C(=O)C2C(C1=O)C(=NO2)/C=C/c1ccccc1

STK630192
Synonyms: 3- [(2- chloro- 7H- purin- 6- yl)sulfanyl]- N- [2- (4- sulfamoylphenyl)ethyl]propanamide
Smiles: O=C(CCSc1nc(Cl)nc2c1[nH]cn2)NCCc1ccc(cc1)S(=O)(=O)N

STK630193
Synonyms: 3- (3- chloro- 1,2- oxazol- 5- yl)- N- [2- (morpholin- 4- ylsulfonyl)ethyl]- N- (pyridin- 4- ylmethyl)propanamide
Smiles: O=C(N(Cc1ccncc1)CCS(=O)(=O)N1CCOCC1)CCc1onc(c1)Cl

STK630195
Synonyms: 5- [(pyridin- 2- ylsulfanyl)methyl][1,2,4]triazolo[1,5- a]pyrimidin- 7- ol
Smiles: Oc1cc(CSc2ccccn2)nc2n1ncn2

STK630196
Synonyms: 5- phenyl- 2- propyl[1,2,4]triazolo[1,5- a]pyrimidin- 7- ol
Smiles: CCCc1nn2c(n1)nc(cc2O)c1ccccc1

STK630200
Synonyms: 2- (4- hydroxyphthalazin- 1- yl)- N- (quinolin- 5- yl)acetamide
Smiles: O=C(Cc1nnc(c2c1cccc2)O)Nc1cccc2c1cccn2

STK630201
Synonyms: 1- (4- hydroxy- 1,1- dioxidotetrahydrothiophen- 3- yl)- 5- imino- 4- (4- methyl- 1,3- thiazol- 2- yl)- 2,5- dihydro- 1H- pyrrol- 3- ol
Smiles: OC1CS(=O)(=O)CC1N1CC(=C(C1=N)c1scc(n1)C)O

STK857116
Synonyms: 2- methyl- 1- [5- (quinoxalin- 6- yl)- 3- (thiophen- 2- yl)- 4,5- dihydro- 1H- pyrazol- 1- yl]propan- 1- one
Smiles: O=C(N1N=C(CC1c1ccc2c(c1)nccn2)c1cccs1)C(C)C

STK630204
Synonyms: N- [2- (morpholin- 4- yl)ethyl]- N~3~- pyrimidin- 2- yl- beta- alaninamide
Smiles: O=C(CCNc1ncccn1)NCCN1CCOCC1

STK630205
Synonyms: (5Z)- 1- (4- bromophenyl)- 5- {[5- (morpholin- 4- yl)furan- 2- yl]methylidene}- 2- sulfanylpyrimidine- 4,6(1H,5H)- dione
Smiles: Brc1ccc(cc1)N1C(=NC(=O)/C(=C/c2ccc(o2)N2CCOCC2)/C1=O)S

STK630208
Synonyms: trans- 4- ({[(4- fluorophenyl)sulfonyl]amino}methyl)- N- [(1S)- 2- hydroxy- 1- phenylethyl]cyclohexanecarboxamide
Smiles: OC[C@H](c1ccccc1)NC(=O)[C@@H]1CC[C@H](CC1)CNS(=O)(=O)c1ccc(cc1)F

STK630210
Synonyms: 2- {4- ethoxy- 3- [(4- phenylpiperazin- 1- yl)sulfonyl]phenyl}- 1,2- thiazolidin- 3- one1,1- dioxide
Smiles: CCOc1ccc(cc1S(=O)(=O)N1CCN(CC1)c1ccccc1)N1C(=O)CCS1(=O)=O

STK630214
Synonyms: 6- (3,4- dimethoxyphenyl)- 2- [(6- methoxy- 4- methylquinazolin- 2- yl)amino]pyrimidin- 4- ol
Smiles: COc1ccc2c(c1)c(C)nc(n2)Nc1nc(O)cc(n1)c1ccc(c(c1)OC)OC

STK857117
Synonyms: ethyl{2- [(Z)- (6- methoxy- 3- oxo- 1- benzofuran- 2(3H)- ylidene)methyl]phenoxy}acetate
Smiles: CCOC(=O)COc1ccccc1/C=C/1\Oc2c(C1=O)ccc(c2)OC

STK630220
Synonyms: N~2~- [(4- hydroxyphthalazin- 1- yl)acetyl]- N- (4- methoxyphenyl)glycinamide
Smiles: COc1ccc(cc1)NC(=O)CNC(=O)Cc1nnc(c2c1cccc2)O

STK630223
Synonyms: N- (5- chloropyridin- 2- yl)- 2- [(5- hydroxy- 2,2- dimethyl- 4- oxo- 3,4- dihydro- 2H- chromen- 7- yl)oxy]acetamide
Smiles: O=C(Nc1ccc(cn1)Cl)COc1cc(O)c2c(c1)OC(CC2=O)(C)C

STK630225
Synonyms: (5E)- N- hydroxy- 10- methyl- 5H- benzo[c]furo[3,2- g]chromen- 5- imine
Smiles: O/N=c\1/oc2cc3occ(c3cc2c2c1cccc2)C

STK630226
Synonyms: 1- (2- methoxyethyl)- 1- [(2- oxo- 1,2- dihydroquinolin- 4- yl)methyl]- 3- [4- (propan- 2- yl)phenyl]thiourea
Smiles: COCCN(C(=S)Nc1ccc(cc1)C(C)C)Cc1cc(=O)[nH]c2c1cccc2

STK630229
Synonyms: 9- (2- fluorophenyl)- 3- (4- methoxyphenyl)- 9,10- dihydro- 4H,8H- chromeno[8,7- e][1,3]oxazin- 4- one
Smiles: COc1ccc(cc1)c1coc2c(c1=O)ccc1c2CN(CO1)c1ccccc1F

STK630230
Synonyms: 2- [3- (4- chlorophenyl)[1,2,4]triazolo[3,4- b][1,3,4]thiadiazol- 6- yl]- 1H- indole
Smiles: Clc1ccc(cc1)c1nnc2n1nc(s2)c1cc2c([nH]1)cccc2

STK630232
Synonyms: 7- [(4- nitrobenzyl)oxy]- 2,3- dihydropyrrolo[2,1- b]quinazolin- 9(1H)- one
Smiles: [O-][N+](=O)c1ccc(cc1)COc1ccc2c(c1)c(=O)n1c(n2)CCC1

STK630234
Synonyms: N- [3- methyl- 2- (phenylcarbonyl)- 1- benzofuran- 5- yl]- 3- (4- oxoquinazolin- 3(4H)- yl)propanamide
Smiles: O=C(Nc1ccc2c(c1)c(C)c(o2)C(=O)c1ccccc1)CCn1cnc2c(c1=O)cccc2

STK630240
Synonyms: (2E)- 2- [(1- ethyl- 1H- indol- 3- yl)methylidene]- 7- methyl- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl(2E)- 3- phenylprop- 2- enoate
Smiles: CCn1cc(c2c1cccc2)/C=C\1/Oc2c(C1=O)ccc(c2C)OC(=O)/C=C/c1ccccc1

STK630242
Synonyms: ethyl3- {[bis(2- hydroxyethyl)carbamoyl]amino}- 7,7- dimethyl- 7,8- dihydro- 5H- pyrano[4,3- b]thieno[3,2- e]pyridine- 2- carboxylate
Smiles: OCCN(C(=O)Nc1c(sc2c1cc1COC(Cc1n2)(C)C)C(=O)OCC)CCO

STK630245
Synonyms: 2- (1H- pyrrol- 1- yl)- N- (1H- 1,2,4- triazol- 3- yl)- 1,3- benzothiazole- 6- carboxamide
Smiles: O=C(c1ccc2c(c1)sc(n2)n1cccc1)Nc1n[nH]cn1

STK630247
Synonyms: 3- methyl- 4- (pyridin- 3- yl)- 4,6,7,8- tetrahydro[1,2]oxazolo[5,4- b]quinolin- 5- ol
Smiles: OC1=C2C(=Nc3c(C2c2cccnc2)c(C)no3)CCC1

STK630248
Synonyms: 2- amino- 4- [2- (2- bromo- 4,5- dimethoxyphenyl)ethyl]- 5- hydroxy[1,3]thiazolo[4,5- d]pyrimidin- 7(4H)- one
Smiles: COc1cc(CCn2c(O)nc(=O)c3c2nc(s3)N)c(cc1OC)Br

STK630249
Synonyms: N- (3- methyl- 1,1- dioxidotetrahydrothiophen- 3- yl)- 2- [(4- oxo- 3,4- dihydrospiro[chromene- 2,1'- cyclohexan]- 7- yl)oxy]acetamide
Smiles: O=C(NC1(C)CCS(=O)(=O)C1)COc1ccc2c(c1)OC1(CC2=O)CCCCC1

STK630253
Synonyms: N- [2- (4- {[4- (2- methoxyphenyl)piperazin- 1- yl]carbonyl}piperidin- 1- yl)- 2- oxoethyl]benzamide
Smiles: COc1ccccc1N1CCN(CC1)C(=O)C1CCN(CC1)C(=O)CNC(=O)c1ccccc1

STK630255
Synonyms: [4- (3- chlorophenyl)piperazin- 1- yl]{1- [(4- methylpiperazin- 1- yl)methyl]- 1H- indol- 3- yl}methanone
Smiles: CN1CCN(CC1)Cn1cc(c2c1cccc2)C(=O)N1CCN(CC1)c1cccc(c1)Cl

STK630258
Synonyms: 2- [(4- hydroxyquinazolin- 2- yl)sulfanyl]- N- [2- (1H- indol- 3- yl)ethyl]acetamide
Smiles: O=C(CSc1nc(O)c2c(n1)cccc2)NCCc1c[nH]c2c1cccc2

STK630262
Synonyms: N- (2,3- dihydro- 1,4- benzodioxin- 6- yl)- 3- [(4S)- 2,5- dioxo- 1- (2- phenylethyl)imidazolidin- 4- yl]propanamide
Smiles: O=C(Nc1ccc2c(c1)OCCO2)CC[C@@H]1NC(=O)N(C1=O)CCc1ccccc1

STK630263
Synonyms: (2Z)- 2- (4- methoxybenzylidene)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yldiphenylcarbamate
Smiles: COc1ccc(cc1)/C=C/1\Oc2c(C1=O)ccc(c2)OC(=O)N(c1ccccc1)c1ccccc1

STK630264
Synonyms: 1- (2- fluorobenzyl)- 2- [1- (thiophen- 2- ylsulfonyl)pyrrolidin- 2- yl]- 1H- benzimidazole
Smiles: Fc1ccccc1Cn1c2ccccc2nc1C1CCCN1S(=O)(=O)c1cccs1

STK630268
Synonyms: 2- butyl- 8,9- dimethyl- 7- [3- (morpholin- 4- yl)propyl]- 7H- pyrrolo[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: CCCCc1nc2n(n1)cnc1c2c(C)c(n1CCCN1CCOCC1)C

STK630269
Synonyms: 3- [(5E)- 5- (4- methoxybenzylidene)- 2,4- dioxo- 1,3- thiazolidin- 3- yl]- N- (quinoxalin- 6- yl)propanamide
Smiles: COc1ccc(cc1)/C=C\1/SC(=O)N(C1=O)CCC(=O)Nc1ccc2c(c1)nccn2

STK630271
Synonyms: (2E)- 6- [(3- methoxybenzyl)oxy]- 7- methyl- 2- [(1- methyl- 1H- indol- 3- yl)methylidene]- 1- benzofuran- 3(2H)- one
Smiles: COc1cccc(c1)COc1ccc2c(c1C)O/C(=C/c1cn(c3c1cccc3)C)/C2=O

STK857118
Synonyms: (2Z)- 3- oxo- 2- (thiophen- 2- ylmethylidene)- 2,3- dihydro- 1- benzofuran- 6- yl4- chlorobenzenesulfonate
Smiles: Clc1ccc(cc1)S(=O)(=O)Oc1ccc2c(c1)O/C(=C\c1cccs1)/C2=O

STK630273
Synonyms: 1- [(2S)- 2- ({[(4R)- 3- (tert- butoxycarbonyl)- 1,3- thiazolidin- 4- yl]carbonyl}amino)- 2- phenylacetyl]piperidine- 4- carboxylicacid
Smiles: O=C([C@@H]1CSCN1C(=O)OC(C)(C)C)N[C@H](C(=O)N1CCC(CC1)C(=O)O)c1ccccc1

STK630277
Synonyms: ethyl4- {[(6,7- dimethoxy- 3,4- dihydroisoquinolin- 2(1H)- yl)carbonyl]amino}benzoate
Smiles: CCOC(=O)c1ccc(cc1)NC(=O)N1CCc2c(C1)cc(c(c2)OC)OC

STK630279
Synonyms: trans- 4- ({[(4- chlorophenyl)sulfonyl]amino}methyl)- N- (pyridin- 4- ylmethyl)cyclohexanecarboxamide
Smiles: O=C([C@@H]1CC[C@H](CC1)CNS(=O)(=O)c1ccc(cc1)Cl)NCc1ccncc1

STK857119
Synonyms: (2Z)- 2- (4- fluorobenzylidene)- 6- [(2- methylprop- 2- en- 1- yl)oxy]- 1- benzofuran- 3(2H)- one
Smiles: CC(=C)COc1ccc2c(c1)O/C(=C\c1ccc(cc1)F)/C2=O

STK630281
Synonyms: N- (1,3- dihydroxy- 2- methylpropan- 2- yl)- 2- (4- methoxyphenyl)quinoline- 4- carboxamide
Smiles: OCC(NC(=O)c1cc(nc2c1cccc2)c1ccc(cc1)OC)(CO)C

STK630283
Synonyms: 2- hydroxy- 5- (4- methylphenyl)- 1- (2- phenylethyl)pyrido[2,3- d]pyrimidin- 4(1H)- one
Smiles: Cc1ccc(cc1)c1ccnc2c1c(=O)nc(n2CCc1ccccc1)O

STK630284
Synonyms: 3- (3,4- dimethoxyphenyl)- 9- (2- methoxyethyl)- 9,10- dihydro- 2H,8H- chromeno[8,7- e][1,3]oxazin- 2- one
Smiles: COCCN1COc2c(C1)c1oc(=O)c(cc1cc2)c1ccc(c(c1)OC)OC

STK630285
Synonyms: 2- chloro- 5- [3- (4- chlorobenzyl)- 5- thioxo- 1,5- dihydro- 4H- 1,2,4- triazol- 4- yl]benzoicacid
Smiles: Clc1ccc(cc1)Cc1n[nH]c(=S)n1c1ccc(c(c1)C(=O)O)Cl

STK630286
Synonyms: 3- (4- cyano- 1- hydroxy- 3- methylpyrido[1,2- a]benzimidazol- 2- yl)- N- (2- oxo- 2H- chromen- 6- yl)propanamide
Smiles: N#Cc1c(C)c(CCC(=O)Nc2ccc3c(c2)ccc(=O)o3)c(n2c1nc1c2cccc1)O

STK630287
Synonyms: 2- oxo- 2- [4- (pyridin- 2- yl)piperazin- 1- yl]- N- (3,4,5- trimethoxyphenyl)acetamide
Smiles: COc1cc(NC(=O)C(=O)N2CCN(CC2)c2ccccn2)cc(c1OC)OC

STK630288
Synonyms: [5- methyl- 7- (naphthalen- 1- yl)- 3,7- dihydro[1,2,4]triazolo[1,5- a]pyrimidin- 6- yl](morpholin- 4- yl)methanone
Smiles: CC1=C(C(=O)N2CCOCC2)C(n2c(=N1)[nH]cn2)c1cccc2c1cccc2

STK630290
Synonyms: 4- ({[3- (4- chlorophenyl)- 4- oxo- 2- (trifluoromethyl)- 4H- chromen- 7- yl]oxy}methyl)- 7- methoxy- 2H- chromen- 2- one
Smiles: COc1ccc2c(c1)oc(=O)cc2COc1ccc2c(c1)oc(c(c2=O)c1ccc(cc1)Cl)C(F)(F)F

STK630293
Synonyms: methyl4- {[2- methyl- 4- oxo- 9- (pyridin- 3- ylmethyl)- 9,10- dihydro- 4H,8H- chromeno[8,7- e][1,3]oxazin- 3- yl]oxy}benzoate
Smiles: COC(=O)c1ccc(cc1)Oc1c(C)oc2c(c1=O)ccc1c2CN(CO1)Cc1cccnc1

STK630294
Synonyms: (3Z)- 3- (2- hydroxybenzylidene)- 2- methyl- 2,3- dihydro- 4H- 1,2- benzothiazin- 4- one1,1- dioxide
Smiles: Oc1ccccc1/C=C\1/C(=O)c2ccccc2S(=O)(=O)N1C

STK630295
Synonyms: N- [(1,5- dimethyl- 1H- pyrazol- 4- yl)methyl]- N'- (1H- indol- 5- yl)ethanediamide
Smiles: O=C(C(=O)NCc1cnn(c1C)C)Nc1ccc2c(c1)cc[nH]2

STK630300
Synonyms: 1- (2- chloro- 7H- purin- 6- yl)- N- (2,2,6,6- tetramethylpiperidin- 4- yl)piperidine- 3- carboxamide
Smiles: O=C(C1CCCN(C1)c1nc(Cl)nc2c1[nH]cn2)NC1CC(C)(C)NC(C1)(C)C

STK630301
Synonyms: [4- (1,3- benzothiazol- 2- yl)piperidin- 1- yl](7- methoxy- 1- benzofuran- 2- yl)methanone
Smiles: COc1cccc2c1oc(c2)C(=O)N1CCC(CC1)c1nc2c(s1)cccc2

STK630304
Synonyms: 3- (4- chlorophenyl)- 4- hydroxy- 8- [(4- methylpiperazin- 1- ium- 1- yl)methyl]- 2- oxo- 2H- chromen- 7- olate
Smiles: CN1CC[NH+](CC1)Cc1c([O-])ccc2c1oc(=O)c(c2O)c1ccc(cc1)Cl

STK630305
Synonyms: 2,6- dimethoxy- N- [4- (1H- 1,2,4- triazol- 1- ylmethyl)phenyl]benzamide
Smiles: COc1cccc(c1C(=O)Nc1ccc(cc1)Cn1cncn1)OC

STK857122
Synonyms: (2Z)- 8- (pyridin- 4- ylmethyl)- 2- (3,4,5- trimethoxybenzylidene)- 8,9- dihydro- 7H- furo[2,3- f][1,3]benzoxazin- 3(2H)- one
Smiles: COc1cc(/C=C/2\Oc3c(C2=O)ccc2c3CN(CO2)Cc2ccncc2)cc(c1OC)OC

STK630308
Synonyms: 1- [4- (3- chlorophenyl)piperazin- 1- yl]- 3- [(2- chloro- 9H- purin- 6- yl)sulfanyl]propan- 1- one
Smiles: Clc1cccc(c1)N1CCN(CC1)C(=O)CCSc1nc(Cl)nc2c1nc[nH]2

STK630309
Synonyms: 6- [4- (N,N- diethylglycyl)piperazin- 1- yl]- 3,3- dimethyl- 8- (propan- 2- yl)- 3,4- dihydro- 1H- pyrano[3,4- c]pyridine- 5- carbonitrile
Smiles: CCN(CC(=O)N1CCN(CC1)c1nc(C(C)C)c2c(c1C#N)CC(OC2)(C)C)CC

STK630312
Synonyms: 2- (3,4- dimethoxyphenyl)- 2- (prop- 2- en- 1- yl)pent- 4- en- 1- amine
Smiles: C=CCC(c1ccc(c(c1)OC)OC)(CC=C)CN

STK630313
Synonyms: 2- [3- (thiophen- 2- yl)[1,2,4]triazolo[3,4- b][1,3,4]thiadiazol- 6- yl]- 1H- indole
Smiles: c1ccc2c(c1)[nH]c(c2)c1nn2c(s1)nnc2c1cccs1

STK630316
Synonyms: methyl2- {(3E)- 3- [hydroxy(3- methoxyphenyl)methylidene]- 4,5- dioxo- 2- [4- (propan- 2- yloxy)phenyl]pyrrolidin- 1- yl}- 4- methyl- 1,3- thiazole- 5- carboxylate
Smiles: COc1cccc(c1)/C(=C\1/C(c2ccc(cc2)OC(C)C)N(C(=O)C1=O)c1sc(c(n1)C)C(=O)OC)/O

STK630317
Synonyms: methyl[(2E)- 2- {[(6- chloro- 7- methoxy- 4- methyl- 2- oxo- 2H- chromen- 3- yl)acetyl]imino}- 2,3- dihydro- 1,3- thiazol- 4- yl]acetate
Smiles: COC(=O)Cc1cs/c(=N/C(=O)Cc2c(=O)oc3c(c2C)cc(c(c3)OC)Cl)/[nH]1

STK630319
Synonyms: 4- (2- methoxyphenyl)- 3- methyl- 4,6,7,8- tetrahydro[1,2]oxazolo[5,4- b]quinolin- 5- ol
Smiles: COc1ccccc1C1C2=C(O)CCCC2=Nc2c1c(C)no2

STK630321
Synonyms: N- {2- [(1,1- dioxidotetrahydrothiophen- 3- yl)amino]- 2- oxoethyl}- 3- phenyl- 2,1- benzoxazole- 5- carboxamide
Smiles: O=C(NC1CCS(=O)(=O)C1)CNC(=O)c1ccc2c(c1)c(on2)c1ccccc1

STK630322
Synonyms: 6- (5- bromopyridin- 3- yl)- 3- [(phenylsulfanyl)methyl][1,2,4]triazolo[3,4- b][1,3,4]thiadiazole
Smiles: Brc1cncc(c1)c1nn2c(s1)nnc2CSc1ccccc1

STK630323
Synonyms: (2Z)- 2- (3- methylbenzylidene)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl1,3- benzodioxole- 5- carboxylate
Smiles: Cc1cccc(c1)/C=C/1\Oc2c(C1=O)ccc(c2)OC(=O)c1ccc2c(c1)OCO2

STK630328
Synonyms: 5- (biphenyl- 4- yl)- 1- (furan- 2- ylmethyl)- 2- hydroxypyrido[2,3- d]pyrimidin- 4(1H)- one
Smiles: Oc1nc(=O)c2c(n1Cc1ccco1)nccc2c1ccc(cc1)c1ccccc1

STK630330
Synonyms: 2- (4- tert- butylphenoxy)- N- [(2E)- 5- (methylsulfonyl)- 1,3,4- thiadiazol- 2(3H)- ylidene]propanamide
Smiles: O=C(C(Oc1ccc(cc1)C(C)(C)C)C)/N=c/1\[nH]nc(s1)S(=O)(=O)C

STK630331
Synonyms: 3- (4- chlorophenyl)- 2- methyl- 9- (tetrahydrofuran- 2- ylmethyl)- 9,10- dihydro- 4H,8H- chromeno[8,7- e][1,3]oxazin- 4- one
Smiles: Clc1ccc(cc1)c1c(C)oc2c(c1=O)ccc1c2CN(CO1)CC1CCCO1

STK630332
Synonyms: N- {2- [3- (4- chlorophenyl)- 1,2,4- oxadiazol- 5- yl]ethyl}- 1- benzofuran- 2- carboxamide
Smiles: Clc1ccc(cc1)c1noc(n1)CCNC(=O)c1cc2c(o1)cccc2

STK630333
Synonyms: N- [2- (piperidin- 1- ylsulfonyl)ethyl]- N- (pyridin- 2- ylmethyl)formamide
Smiles: O=CN(Cc1ccccn1)CCS(=O)(=O)N1CCCCC1

STK857123
Synonyms: 2- hydroxy- 4- methoxy- N- (4- phenylbutan- 2- yl)benzamide
Smiles: COc1ccc(c(c1)O)C(=O)NC(CCc1ccccc1)C

STK630335
Synonyms: 3- (4- chlorophenyl)- 5- (4- fluorophenyl)- 3aH- pyrrolo[3,4- d][1,2]oxazole- 4,6(5H,6aH)- dione
Smiles: Fc1ccc(cc1)N1C(=O)C2C(C1=O)C(=NO2)c1ccc(cc1)Cl

STK630336
Synonyms: 3- (4- methoxyphenyl)- 10- methyl- 8,9,10,11- tetrahydro[1]benzothieno[3,2- e][1,2,4]triazolo[4,3- c]pyrimidine
Smiles: COc1ccc(cc1)c1nnc2n1cnc1c2c2CC(C)CCc2s1

STK630337
Synonyms: N- (5- carbamoyl- 1- methyl- 1H- pyrazol- 4- yl)- N'- [(1,3,5- trimethyl- 1H- pyrazol- 4- yl)methyl]ethanediamide
Smiles: O=C(C(=O)NCc1c(C)nn(c1C)C)Nc1cnn(c1C(=O)N)C

STK630339
Synonyms: 3- (2- chlorophenyl)- 6- [5- (2- methylpropyl)- 1H- pyrazol- 3- yl][1,2,4]triazolo[3,4- b][1,3,4]thiadiazole
Smiles: CC(Cc1[nH]nc(c1)c1nn2c(s1)nnc2c1ccccc1Cl)C

STK857125
Synonyms: (2Z)- 2- [(6- chloro- 4H- 1,3- benzodioxin- 8- yl)methylidene]- 3- oxo- 7- (pyrrolidinium- 1- ylmethyl)- 2,3- dihydro- 1- benzofuran- 6- olate
Smiles: Clc1cc(/C=C/2\Oc3c(C2=O)ccc(c3C[NH+]2CCCC2)[O-])c2c(c1)COCO2

STK630347
Synonyms: N- (furan- 2- ylmethyl)- 1- (1H- indol- 3- ylacetyl)piperidine- 3- carboxamide
Smiles: O=C(C1CCCN(C1)C(=O)Cc1c[nH]c2c1cccc2)NCc1ccco1

STK630348
Synonyms: 3- (3,4- dimethoxyphenyl)- 9- [3- (morpholin- 4- yl)propyl]- 9,10- dihydro- 4H,8H- chromeno[8,7- e][1,3]oxazin- 4- one
Smiles: COc1cc(ccc1OC)c1coc2c(c1=O)ccc1c2CN(CCCN2CCOCC2)CO1

STK630349
Synonyms: 2- (ethylsulfanyl)- 1- (2- methoxybenzyl)- 3a,4,6,6a- tetrahydro- 1H- thieno[3,4- d]imidazole5,5- dioxide
Smiles: CCSC1=NC2C(N1Cc1ccccc1OC)CS(=O)(=O)C2

STK630350
Synonyms: ethyl2- (morpholin- 4- yl)- 6- oxo- 4- (pyridin- 3- yl)- 1,4,5,6- tetrahydropyrimidine- 5- carboxylate
Smiles: CCOC(=O)C1C(=O)NC(=NC1c1cccnc1)N1CCOCC1

STK630352
Synonyms: 3- (4- chlorophenyl)- 2- methyl- 5- {[(4- methylpyrimidin- 2- yl)sulfanyl]methyl}pyrazolo[1,5- a]pyrimidin- 7- ol
Smiles: Clc1ccc(cc1)c1c(C)nn2c1nc(CSc1nccc(n1)C)cc2O

STK630353
Synonyms: 7- {2- [4- (2- hydroxyethyl)piperazin- 1- yl]- 2- oxoethoxy}- 3- (4- methoxyphenyl)- 2- methyl- 4H- chromen- 4- one
Smiles: OCCN1CCN(CC1)C(=O)COc1ccc2c(c1)oc(c(c2=O)c1ccc(cc1)OC)C

STK630355
Synonyms: 1- (2,2- diphenylethyl)- 5- imino- 4- (4- methyl- 1,3- thiazol- 2- yl)- 2,5- dihydro- 1H- pyrrol- 3- ol
Smiles: Cc1csc(n1)C1=C(O)CN(C1=N)CC(c1ccccc1)c1ccccc1

STK630357
Synonyms: 3- [(5Z)- 5- (2- fluorobenzylidene)- 2,4- dioxo- 1,3- thiazolidin- 3- yl]- N- (2- oxo- 2H- chromen- 6- yl)propanamide
Smiles: O=C(Nc1ccc2c(c1)ccc(=O)o2)CCN1C(=O)S/C(=C\c2ccccc2F)/C1=O

STK630363
Synonyms: 8- ethyl- 2,9- dimethyl- N- (tetrahydrofuran- 2- ylmethyl)thieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 5- amine
Smiles: CCc1sc2c(c1C)c1nc(nn1c(n2)NCC1CCCO1)C

STK630364
Synonyms: 8- {2- [(2- chlorophenyl)amino]ethyl}- 4- hydroxy- 1,7- dimethyl- 1H- imidazo[2,1- f]purin- 2(8H)- one
Smiles: Clc1ccccc1NCCn1c(C)cn2c1nc1c2c(O)nc(=O)n1C

STK630368
Synonyms: N- [2- (4- {[4- (2- hydroxyethyl)piperazin- 1- yl]carbonyl}piperidin- 1- yl)- 2- oxoethyl]benzamide
Smiles: OCCN1CCN(CC1)C(=O)C1CCN(CC1)C(=O)CNC(=O)c1ccccc1

STK630372
Synonyms: 2- [4- imino- 5,6- dimethyl- 3- (pyridin- 2- ylmethyl)- 3,4- dihydro- 7H- pyrrolo[2,3- d]pyrimidin- 7- yl]ethanol
Smiles: OCCn1c(C)c(c2c1ncn(c2=N)Cc1ccccn1)C

STK630374
Synonyms: 4- hydroxy- N- {(5Z)- 5- [(1- methyl- 1,2,3,4- tetrahydroquinolin- 6- yl)methylidene]- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl}benzamide
Smiles: Oc1ccc(cc1)C(=O)NN1C(=S)S/C(=C\c2ccc3c(c2)CCCN3C)/C1=O

STK630378
Synonyms: 2- [(1'- acetyl- 4- oxo- 3,4- dihydrospiro[chromene- 2,4'- piperidin]- 7- yl)oxy]- N- (pyridin- 2- yl)acetamide
Smiles: O=C(Nc1ccccn1)COc1ccc2c(c1)OC1(CC2=O)CCN(CC1)C(=O)C

STK630379
Synonyms: (2Z)- 2- (pyridin- 3- ylmethylidene)- 8- (thiophen- 2- ylmethyl)- 8,9- dihydro- 7H- furo[2,3- f][1,3]benzoxazin- 3(2H)- one
Smiles: O=C1/C(=C/c2cccnc2)/Oc2c1ccc1c2CN(CO1)Cc1cccs1

STK630381
Synonyms: (4E)- 4- (hydroxy{4- [(3- methylbenzyl)oxy]phenyl}methylidene)- 5- (4- nitrophenyl)- 1- (pyridin- 3- ylmethyl)pyrrolidine- 2,3- dione
Smiles: Cc1cccc(c1)COc1ccc(cc1)/C(=C\1/C(c2ccc(cc2)[N+](=O)[O-])N(C(=O)C1=O)Cc1cccnc1)/O

STK630383
Synonyms: 1- [N- (phenylcarbonyl)glycyl]piperidine- 4- carboxylicacid
Smiles: O=C(N1CCC(CC1)C(=O)O)CNC(=O)c1ccccc1

STK630385
Synonyms: 2- (3,5- dimethyl- 1H- pyrazol- 1- yl)- 6,6- dimethyl- N- [2- (morpholin- 4- yl)ethyl]- 5,8- dihydro- 6H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- amine
Smiles: Cc1nn(c(c1)C)c1nc(NCCN2CCOCC2)c2c(n1)sc1c2CC(OC1)(C)C

STK630386
Synonyms: N- (2- chlorobenzyl)- 2- {[3- (3,4- dimethoxyphenyl)- 4- oxo- 4H- chromen- 7- yl]oxy}acetamide
Smiles: COc1cc(ccc1OC)c1coc2c(c1=O)ccc(c2)OCC(=O)NCc1ccccc1Cl

STK630387
Synonyms: N- [7- (5- methoxy- 1H- indol- 3- yl)- 5- methyl- 3,7- dihydro[1,2,4]triazolo[1,5- a]pyrimidin- 6- yl]benzamide
Smiles: COc1ccc2c(c1)c(c[nH]2)C1C(=C(C)N=c2n1nc[nH]2)NC(=O)c1ccccc1

STK857131
Synonyms: (2Z)- 2- [(6- chloro- 4H- 1,3- benzodioxin- 8- yl)methylidene]- 3- oxo- 7- (piperidinium- 1- ylmethyl)- 2,3- dihydro- 1- benzofuran- 6- olate
Smiles: Clc1cc(/C=C/2\Oc3c(C2=O)ccc(c3C[NH+]2CCCCC2)[O-])c2c(c1)COCO2

STK630391
Synonyms: 4- hydroxy- 3,6,6- trimethyl- N- (naphthalen- 1- yl)- 4,5,6,7- tetrahydro- 1- benzofuran- 2- carboxamide
Smiles: O=C(c1oc2c(c1C)C(O)CC(C2)(C)C)Nc1cccc2c1cccc2

STK630393
Synonyms: 2,5,6- trihydroxy- 5- (5- methyl- 3- oxo- 2- phenyl- 2,3- dihydro- 1H- pyrazol- 4- yl)pyrimidin- 4(5H)- one
Smiles: OC1=NC(=O)C(C(=N1)O)(O)c1c(C)[nH]n(c1=O)c1ccccc1

STK630394
Synonyms: 7- (furan- 2- ylmethyl)- 8,9- dimethyl- 2- (2- methylpropyl)- 7H- pyrrolo[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: CC(Cc1nn2c(n1)c1c(nc2)n(c(c1C)C)Cc1ccco1)C

STK630395
Synonyms: 2- (4- hydroxyphthalazin- 1- yl)- N- [4- (morpholin- 4- ylmethyl)phenyl]acetamide
Smiles: O=C(Cc1nnc(c2c1cccc2)O)Nc1ccc(cc1)CN1CCOCC1

STK630397
Synonyms: 4- (2,4- dichlorophenyl)- 5- (quinoxalin- 6- yl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: Clc1ccc(c(c1)Cl)n1c(=S)[nH]nc1c1ccc2c(c1)nccn2

STK630400
Synonyms: 3- (4- chlorophenyl)- 4- {[(Z)- (2,6- dihydroxy- 4- oxopyrimidin- 5(4H)- ylidene)methyl]amino}butanoicacid
Smiles: OC(=O)CC(c1ccc(cc1)Cl)CN/C=C\1/C(=NC(=NC1=O)O)O

STK630401
Synonyms: 2- [(2- chloro- 7H- purin- 6- yl)sulfanyl]- N- [2- (4- methoxyphenyl)ethyl]acetamide
Smiles: COc1ccc(cc1)CCNC(=O)CSc1nc(Cl)nc2c1[nH]cn2

STK857133
Synonyms: 3- (4- methoxyphenoxy)- 4- oxo- 4H- chromen- 7- yl2- chlorobenzoate
Smiles: COc1ccc(cc1)Oc1coc2c(c1=O)ccc(c2)OC(=O)c1ccccc1Cl

STK630403
Synonyms: tert- butyl({(2E)- 2- [(1- methyl- 1H- indol- 3- yl)methylidene]- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl}oxy)acetate
Smiles: O=C(OC(C)(C)C)COc1ccc2c(c1)O/C(=C/c1cn(c3c1cccc3)C)/C2=O

STK857134
Synonyms: 2- (4- chlorophenyl)- 6- methoxy- 4H- chromen- 4- one
Smiles: COc1ccc2c(c1)c(=O)cc(o2)c1ccc(cc1)Cl

STK630404
Synonyms: 7'- benzyl- 6'- methyl- 3',4'- dihydro- 8'H- spiro[cyclohexane- 1,2'- pyrano[3,2- g]chromen]- 8'- one
Smiles: O=c1oc2cc3OC4(CCCCC4)CCc3cc2c(c1Cc1ccccc1)C

STK857136
Synonyms: propan- 2- yl2- {[3- (4- ethylphenoxy)- 4- oxo- 4H- chromen- 7- yl]oxy}propanoate
Smiles: CCc1ccc(cc1)Oc1coc2c(c1=O)ccc(c2)OC(C(=O)OC(C)C)C

STK857137
Synonyms: propan- 2- yl{[(2Z)- 2- (3- methylbenzylidene)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl]oxy}acetate
Smiles: CC(OC(=O)COc1ccc2c(c1)O/C(=C\c1cccc(c1)C)/C2=O)C

STK630406
Synonyms: (2E)- 2- [(5- methoxy- 1- methyl- 1H- indol- 3- yl)methylidene]- 7- methyl- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl2- chlorobenzoate
Smiles: COc1ccc2c(c1)c(/C=C\1/Oc3c(C1=O)ccc(c3C)OC(=O)c1ccccc1Cl)cn2C

STK630408
Synonyms: N- (3- chloro- 4- fluorophenyl)- 1- (5- nitropyridin- 2- yl)piperidine- 3- carboxamide
Smiles: O=C(C1CCCN(C1)c1ccc(cn1)[N+](=O)[O-])Nc1ccc(c(c1)Cl)F

STK630412
Synonyms: (2E)- 2- [(1- methyl- 1H- indol- 3- yl)methylidene]- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl4- methylbenzoate
Smiles: Cc1ccc(cc1)C(=O)Oc1ccc2c(c1)O/C(=C/c1cn(c3c1cccc3)C)/C2=O

STK630413
Synonyms: N~2~- (2- chloro- 7H- purin- 6- yl)- N- (3- hydroxypropyl)glycinamide
Smiles: OCCCNC(=O)CNc1nc(Cl)nc2c1[nH]cn2

STK630417
Synonyms: 2,4- dichloro- N- [2- (morpholin- 4- ylsulfonyl)ethyl]- N- (pyridin- 2- ylmethyl)benzamide
Smiles: Clc1ccc(c(c1)Cl)C(=O)N(Cc1ccccn1)CCS(=O)(=O)N1CCOCC1

STK630418
Synonyms: (2E)- 2- [(1- ethyl- 1H- indol- 3- yl)methylidene]- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- ylbenzoate
Smiles: CCn1cc(c2c1cccc2)/C=C\1/Oc2c(C1=O)ccc(c2)OC(=O)c1ccccc1

STK630423
Synonyms: N- [3- (1H- benzimidazol- 2- yl)- 1- cyclopentyl- 4,5- dimethyl- 1H- pyrrol- 2- yl]propanamide
Smiles: CCC(=O)Nc1c(c2nc3c([nH]2)cccc3)c(c(n1C1CCCC1)C)C

STK630426
Synonyms: 3- (3- chlorophenyl)- 6- {1- [4- (2- methylpropyl)phenyl]ethyl}[1,2,4]triazolo[3,4- b][1,3,4]thiadiazole
Smiles: CC(Cc1ccc(cc1)C(c1nn2c(s1)nnc2c1cccc(c1)Cl)C)C

STK630427
Synonyms: 2',3',9',10'- tetrahydrospiro[cyclohexane- 1,8'- cyclopenta[c]pyrano[3,2- g]chromene]- 4'(1'H)- thione
Smiles: S=c1oc2cc3OC4(CCCCC4)CCc3cc2c2c1CCC2

STK630428
Synonyms: 6- bromo- 3- hydroxy- 3- [2- (3- methoxyphenyl)- 2- oxoethyl]- 1,3- dihydro- 2H- indol- 2- one
Smiles: COc1cccc(c1)C(=O)CC1(O)C(=O)Nc2c1ccc(c2)Br

STK630430
Synonyms: 2- {2- [({[(E)- (4- chlorophenyl)methylidene]amino}oxy)methyl]- 8,9- dimethyl- 7H- pyrrolo[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 7- yl}ethanol
Smiles: OCCn1c(C)c(c2c1ncn1c2nc(n1)CO/N=C/c1ccc(cc1)Cl)C

STK630431
Synonyms: N- butyl- N- [(6- methoxy- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]pyridine- 2- carboxamide
Smiles: CCCCN(C(=O)c1ccccn1)Cc1cc2cc(OC)ccc2[nH]c1=O

STK630432
Synonyms: 8- {3- [(4- fluorophenyl)amino]propyl}- 4- hydroxy- 1,7- dimethyl- 1H- imidazo[2,1- f]purin- 2(8H)- one
Smiles: Fc1ccc(cc1)NCCCn1c(C)cn2c1nc1c2c(O)nc(=O)n1C

STK630433
Synonyms: 4- (4,5- dimethyl- 1,3- thiazol- 2- yl)- 1- (1,1- dioxidotetrahydrothiophen- 3- yl)- 5- imino- 2,5- dihydro- 1H- pyrrol- 3- ol
Smiles: OC1=C(c2sc(c(n2)C)C)C(=N)N(C1)C1CCS(=O)(=O)C1

STK857139
Synonyms: methyl4- {[7- (2- methoxy- 2- oxoethoxy)- 4- oxo- 4H- chromen- 3- yl]oxy}benzoate
Smiles: COC(=O)COc1ccc2c(c1)occ(c2=O)Oc1ccc(cc1)C(=O)OC

STK630434
Synonyms: N- {[3- (4- chlorophenyl)- 1,2,4- oxadiazol- 5- yl]methyl}- 7- methoxy- 1- benzofuran- 2- carboxamide
Smiles: COc1cccc2c1oc(c2)C(=O)NCc1onc(n1)c1ccc(cc1)Cl

STK630436
Synonyms: 3- benzyl- 7- cyclohexyl- 5,6- dimethyl- 3,7- dihydro- 4H- pyrrolo[2,3- d]pyrimidin- 4- imine
Smiles: Cc1c(C)n(c2c1c(=N)n(cn2)Cc1ccccc1)C1CCCCC1

STK630438
Synonyms: methyl1- {(1E)- 2- cyano- 3- [(furan- 2- ylmethyl)amino]- 3- oxoprop- 1- en- 1- yl}piperidine- 4- carboxylate
Smiles: N#C/C(=C\N1CCC(CC1)C(=O)OC)/C(=O)NCc1ccco1

STK857140
Synonyms: N- (4- {[1- (4- fluorophenyl)- 1H- tetrazol- 5- yl]methoxy}phenyl)acetamide
Smiles: CC(=O)Nc1ccc(cc1)OCc1nnnn1c1ccc(cc1)F

STK630442
Synonyms: (2E)- 2- {[(4- chlorophenyl)sulfonyl]imino}- N- (pyridin- 3- ylmethyl)- 2,3- dihydro- 1,3- benzothiazole- 6- carboxamide
Smiles: Clc1ccc(cc1)S(=O)(=O)/N=c/1\[nH]c2c(s1)cc(cc2)C(=O)NCc1cccnc1

STK630444
Synonyms: 3- [(4- bromophenoxy)methyl]- 6- [5- (2- methylpropyl)- 1H- pyrazol- 3- yl][1,2,4]triazolo[3,4- b][1,3,4]thiadiazole
Smiles: CC(Cc1[nH]nc(c1)c1nn2c(s1)nnc2COc1ccc(cc1)Br)C

STK630445
Synonyms: N- benzyl- 5,6- dimethyl- 7- (pyridin- 4- ylmethyl)- 7H- pyrrolo[2,3- d]pyrimidin- 4- amine
Smiles: Cc1n(Cc2ccncc2)c2c(c1C)c(ncn2)NCc1ccccc1

STK630446
Synonyms: 3- [(5Z)- 5- (3- chlorobenzylidene)- 2,4- dioxo- 1,3- thiazolidin- 3- yl]- N- (1,1- dioxidotetrahydrothiophen- 3- yl)propanamide
Smiles: O=C(NC1CCS(=O)(=O)C1)CCN1C(=O)S/C(=C\c2cccc(c2)Cl)/C1=O

STK630448
Synonyms: (2Z)- 2- [(3- methylthiophen- 2- yl)methylidene]- 6- [(pentafluorobenzyl)oxy]- 1- benzofuran- 3(2H)- one
Smiles: O=C1/C(=C/c2sccc2C)/Oc2c1ccc(c2)OCc1c(F)c(F)c(c(c1F)F)F

STK630450
Synonyms: 1- ({(E)- [4- (dimethylamino)phenyl]methylidene}amino)- 5- imino- 4- (4- methyl- 1,3- thiazol- 2- yl)- 2,5- dihydro- 1H- pyrrol- 3- ol
Smiles: Cc1csc(n1)C1=C(O)CN(C1=N)/N=C/c1ccc(cc1)N(C)C

STK630451
Synonyms: (E)- N- {[7- (1,3- benzothiazol- 2- yl)- 8,9- dimethyl- 7H- pyrrolo[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 2- yl]methoxy}- 1- (4- chlorophenyl)methanimine
Smiles: Clc1ccc(cc1)/C=N/OCc1nn2c(n1)c1c(nc2)n(c(c1C)C)c1nc2c(s1)cccc2

STK630452
Synonyms: 5- (6,7- dimethoxy- 1,2,3,4- tetrahydroisoquinolinium- 1- yl)- 4- hydroxy- 6- oxo- 1- (propan- 2- yl)- 1,6- dihydropyrimidine- 2- thiolate
Smiles: COc1cc2c(cc1OC)CC[NH2+]C2c1c(O)nc(n(c1=O)C(C)C)[S-]

STK630453
Synonyms: N- {[4- (1H- indol- 2- ylcarbonyl)piperazin- 1- yl]carbonyl}- L- alanine
Smiles: OC(=O)[C@@H](NC(=O)N1CCN(CC1)C(=O)c1cc2c([nH]1)cccc2)C

STK630457
Synonyms: N,N- dimethyl- 4- [6- (quinolin- 2- yl)[1,2,4]triazolo[3,4- b][1,3,4]thiadiazol- 3- yl]aniline
Smiles: CN(c1ccc(cc1)c1nnc2n1nc(s2)c1ccc2c(n1)cccc2)C

STK630460
Synonyms: N- (4,6- dimethyl- 1H- pyrazolo[3,4- b]pyridin- 3- yl)- 2- [4- (4- methoxyphenyl)piperazin- 1- yl]- 2- oxoacetamide
Smiles: COc1ccc(cc1)N1CCN(CC1)C(=O)C(=O)Nc1n[nH]c2c1c(C)cc(n2)C

STK630461
Synonyms: (2E)- 6- ethoxy- 2- [(1- methyl- 1H- indol- 3- yl)methylidene]- 1- benzofuran- 3(2H)- one
Smiles: CCOc1ccc2c(c1)O/C(=C/c1cn(c3c1cccc3)C)/C2=O

STK630462
Synonyms: 4- hydroxy- 2- [4- (pyrimidin- 2- yl)piperazin- 1- yl]- 1,3- diazaspiro[5.5]undeca- 1,3- diene- 5- carbonitrile
Smiles: N#CC1C(=NC(=NC21CCCCC2)N1CCN(CC1)c1ncccn1)O

STK630465
Synonyms: N- (1,1- dioxidotetrahydrothiophen- 3- yl)- 4- (2- hydroxy- 4- oxoquinazolin- 3(4H)- yl)- N- methylbutanamide
Smiles: O=C(N(C1CCS(=O)(=O)C1)C)CCCn1c(O)nc2c(c1=O)cccc2

STK630469
Synonyms: 1- (2- ethylhexyl)- 5- imino- 4- (4- methyl- 1,3- thiazol- 2- yl)- 2,5- dihydro- 1H- pyrrol- 3- ol
Smiles: CCCCC(CN1CC(=C(C1=N)c1scc(n1)C)O)CC

STK630470
Synonyms: N- tert- butyl- 2- {[3- (4- chlorophenyl)- 2- methyl- 4- oxo- 4H- chromen- 7- yl]oxy}acetamide
Smiles: O=C(NC(C)(C)C)COc1ccc2c(c1)oc(c(c2=O)c1ccc(cc1)Cl)C

STK630471
Synonyms: 2- (benzylsulfanyl)- 1- [2- (4- fluorophenyl)ethyl]- 3a,4,6,6a- tetrahydro- 1H- thieno[3,4- d]imidazole5,5- dioxide
Smiles: Fc1ccc(cc1)CCN1C(=NC2C1CS(=O)(=O)C2)SCc1ccccc1

STK630472
Synonyms: 9- (4- methoxybenzyl)- 2- methyl- 3- phenyl- 9,10- dihydro- 4H,8H- chromeno[8,7- e][1,3]oxazin- 4- one
Smiles: COc1ccc(cc1)CN1COc2c(C1)c1oc(C)c(c(=O)c1cc2)c1ccccc1

STK630473
Synonyms: N- [(2Z)- 1,3- benzothiazol- 2(3H)- ylidene]- 7- methoxy- 1- benzofuran- 2- carboxamide
Smiles: COc1cccc2c1oc(c2)C(=O)/N=c/1\sc2c([nH]1)cccc2

STK630475
Synonyms: 2- [5- (4- ethylphenyl)- 3- phenyl- 4,5- dihydro- 1H- pyrazol- 1- yl]- 4- methyl- 1,3- thiazole
Smiles: CCc1ccc(cc1)C1CC(=NN1c1scc(n1)C)c1ccccc1

STK630482
Synonyms: 8- (dimethylamino)- 2- hydroxy- 3- (3- methoxypropyl)benzo[g]pteridin- 4(3H)- one
Smiles: COCCCn1c(O)nc2c(c1=O)nc1c(n2)cc(cc1)N(C)C

STK630483
Synonyms: (2Z)- 2- (furan- 2- ylmethylidene)- 8- (2- methoxybenzyl)- 8,9- dihydro- 7H- furo[2,3- f][1,3]benzoxazin- 3(2H)- one
Smiles: COc1ccccc1CN1COc2c(C1)c1O/C(=C\c3ccco3)/C(=O)c1cc2

STK630484
Synonyms: 1- cyclopropyl- 6,7- difluoro- 8- methoxy- 4- oxo- N- (pyridin- 3- yl)- 1,4- dihydroquinoline- 3- carboxamide
Smiles: COc1c(F)c(F)cc2c1n(cc(c2=O)C(=O)Nc1cccnc1)C1CC1

STK630485
Synonyms: N- {[(12- oxo- 6,7,8,9,10,12- hexahydroazepino[2,1- b]quinazolin- 2- yl)oxy]acetyl}- L- leucine
Smiles: CC(C[C@@H](C(=O)O)NC(=O)COc1ccc2c(c1)c(=O)n1c(n2)CCCCC1)C

STK630486
Synonyms: 4- (4- hydroxyphenyl)- 3,7,7- trimethyl- 4,6,7,8- tetrahydro[1,2]oxazolo[5,4- b]quinolin- 5- ol
Smiles: Oc1ccc(cc1)C1C2=C(O)CC(CC2=Nc2c1c(C)no2)(C)C

STK630492
Synonyms: 5,6- dimethyl- 7- (6- methylpyridin- 2- yl)- 3- [3- (morpholin- 4- yl)propyl]- 3,7- dihydro- 4H- pyrrolo[2,3- d]pyrimidin- 4- imine
Smiles: Cc1c2c(=N)n(CCCN3CCOCC3)cnc2n(c1C)c1cccc(n1)C

STK630493
Synonyms: 8- methoxy- 3- {[2- (morpholin- 4- yl)ethyl]sulfanyl}- 5H- [1,2,4]triazino[5,6- b]indole
Smiles: COc1ccc2c(c1)c1nnc(nc1[nH]2)SCCN1CCOCC1

STK630496
Synonyms: 2,4- dichloro- N- [4- (5,6,7,8- tetrahydronaphthalen- 2- yl)- 1,2,5- oxadiazol- 3- yl]benzamide
Smiles: Clc1ccc(c(c1)Cl)C(=O)Nc1nonc1c1ccc2c(c1)CCCC2

STK630500
Synonyms: 2- {[3- (4- chlorophenyl)- 4- oxo- 4H- chromen- 7- yl]oxy}- N- (1- phenylethyl)acetamide
Smiles: O=C(NC(c1ccccc1)C)COc1ccc2c(c1)occ(c2=O)c1ccc(cc1)Cl

STK630503
Synonyms: 3- (4- bromophenyl)- 2- methyl- 4- oxo- 4H- chromen- 7- yl3,4- dimethoxybenzoate
Smiles: COc1cc(ccc1OC)C(=O)Oc1ccc2c(c1)oc(c(c2=O)c1ccc(cc1)Br)C

STK630506
Synonyms: (2Z)- 2- {[(4- fluorophenyl)sulfonyl]imino}- 2,3- dihydro- 1,3- benzothiazole- 6- carboxylicacid
Smiles: Fc1ccc(cc1)S(=O)(=O)/N=c/1\sc2c([nH]1)ccc(c2)C(=O)O

STK630509
Synonyms: N- (pyridin- 4- ylmethyl)- N~3~- pyrimidin- 2- yl- beta- alaninamide
Smiles: O=C(NCc1ccncc1)CCNc1ncccn1

STK630510
Synonyms: (3Z)- 3- {[5- (dimethylamino)thiophen- 2- yl]methylidene}- 2- (pyridin- 4- ylmethyl)- 2,3- dihydro- 4H- 1,2- benzothiazin- 4- one1,1- dioxide
Smiles: CN(c1ccc(s1)/C=C\1/C(=O)c2ccccc2S(=O)(=O)N1Cc1ccncc1)C

STK857146
Synonyms: 9- (3- chloro- 4- methoxyphenyl)- 3- phenyl- 9,10- dihydro- 4H,8H- chromeno[8,7- e][1,3]oxazin- 4- one
Smiles: COc1ccc(cc1Cl)N1COc2c(C1)c1occ(c(=O)c1cc2)c1ccccc1

STK630512
Synonyms: 2- (7- hydroxy- 5- methyl[1,2,4]triazolo[1,5- a]pyrimidin- 2- yl)- 1- [4- (2- methoxyphenyl)piperazin- 1- yl]ethanone
Smiles: COc1ccccc1N1CCN(CC1)C(=O)Cc1nn2c(n1)nc(cc2O)C

STK630513
Synonyms: (2E)- 2- [(1- ethyl- 1H- indol- 3- yl)methylidene]- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl(2E)- 3- phenylprop- 2- enoate
Smiles: CCn1cc(c2c1cccc2)/C=C\1/Oc2c(C1=O)ccc(c2)OC(=O)/C=C/c1ccccc1

STK630515
Synonyms: 3- (3- chloro- 4- fluorophenyl)- 6- [(2- methoxyphenoxy)methyl][1,2,4]triazolo[3,4- b][1,3,4]thiadiazole
Smiles: COc1ccccc1OCc1nn2c(s1)nnc2c1ccc(c(c1)Cl)F

STK630523
Synonyms: 2- {(1E)- 5- fluoro- 2- methyl- 1- [4- (methylsulfinyl)benzylidene]- 1H- inden- 3- yl}- N- (2- hydroxy- 5- methylphenyl)acetamide
Smiles: Fc1ccc2c(c1)C(=C(/C/2=C\c1ccc(cc1)S(=O)C)C)CC(=O)Nc1cc(C)ccc1O

STK630524
Synonyms: 7- (2,3- dihydro- 1H- indol- 1- yl)- 9- hydroxy- 6,8- diazaspiro[4.5]deca- 6,8- diene- 10- carbonitrile
Smiles: N#CC1C(=NC(=NC21CCCC2)N1CCc2c1cccc2)O

STK630527
Synonyms: 2,5,6- trihydroxy- 5- (3- hydroxy- 5- methyl- 1H- pyrazol- 4- yl)pyrimidin- 4(5H)- one
Smiles: OC1=NC(=O)C(C(=N1)O)(O)c1c(O)n[nH]c1C

STK630531
Synonyms: ethyl{[4- (7- methoxy- 1- benzofuran- 2- yl)- 2- oxo- 7- phenyl- 2H- chromen- 6- yl]oxy}acetate
Smiles: CCOC(=O)COc1cc2c(cc1c1ccccc1)oc(=O)cc2c1cc2c(o1)c(OC)ccc2

STK630535
Synonyms: 2- [(5Z)- 5- (furan- 2- ylmethylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- [3- (2- oxopyrrolidin- 1- yl)propyl]acetamide
Smiles: O=C(CN1C(=S)S/C(=C\c2ccco2)/C1=O)NCCCN1CCCC1=O

STK857147
Synonyms: ethyl3- [5- (ethoxycarbonyl)furan- 2- yl]- 6- ethyl- 7- hydroxy- 4- oxo- 4H- chromene- 2- carboxylate
Smiles: CCOC(=O)c1oc2cc(O)c(cc2c(=O)c1c1ccc(o1)C(=O)OCC)CC

STK630538
Synonyms: (5E)- 3- (3- hydroxyphenyl)- 5- (quinoxalin- 2- ylmethylidene)- 2- thioxo- 1,3- thiazolidin- 4- one
Smiles: Oc1cccc(c1)N1C(=S)S/C(=C/c2cnc3c(n2)cccc3)/C1=O

STK630539
Synonyms: methyl4- [5- hydroxy- 7- (4- methoxyphenyl)- 3- methyl- 4,6,7,8- tetrahydro[1,2]oxazolo[5,4- b]quinolin- 4- yl]benzoate
Smiles: COc1ccc(cc1)C1CC(=C2C(=Nc3c(C2c2ccc(cc2)C(=O)OC)c(no3)C)C1)O

STK630540
Synonyms: (2Z)- 8- [2- (morpholin- 4- yl)ethyl]- 2- (3,4,5- trimethoxybenzylidene)- 8,9- dihydro- 7H- furo[2,3- f][1,3]benzoxazin- 3(2H)- one
Smiles: COc1cc(/C=C/2\Oc3c(C2=O)ccc2c3CN(CCN3CCOCC3)CO2)cc(c1OC)OC

STK630542
Synonyms: 5- ethyl- N- (2- hydroxy- 5- methylphenyl)- 8- oxo- 5,8- dihydro[1,3]dioxolo[4,5- g]quinoline- 7- carboxamide
Smiles: CCn1cc(C(=O)Nc2cc(C)ccc2O)c(=O)c2c1cc1OCOc1c2

STK630544
Synonyms: 9- (2,4- dimethoxyphenyl)- 3- phenyl- 9,10- dihydro- 4H,8H- chromeno[8,7- e][1,3]oxazin- 4- one
Smiles: COc1cc(OC)ccc1N1COc2c(C1)c1occ(c(=O)c1cc2)c1ccccc1

STK630545
Synonyms: (2Z)- 8- (2- methoxyphenyl)- 2- (3,4,5- trimethoxybenzylidene)- 8,9- dihydro- 7H- furo[2,3- f][1,3]benzoxazin- 3(2H)- one
Smiles: COc1cc(/C=C/2\Oc3c(C2=O)ccc2c3CN(CO2)c2ccccc2OC)cc(c1OC)OC

STK630548
Synonyms: 8- methyl- 4- phenyl- 2- (4- phenylpiperazin- 1- yl)- 4H- pyrimido[1,2- a][1,3,5]triazin- 6- ol
Smiles: Cc1cc(O)n2c(=NC(=NC2c2ccccc2)N2CCN(CC2)c2ccccc2)n1

STK630549
Synonyms: 3- methoxy- N- [2- (methylsulfamoyl)ethyl]- N- (pyridin- 4- ylmethyl)benzamide
Smiles: COc1cccc(c1)C(=O)N(Cc1ccncc1)CCS(=O)(=O)NC

STK630551
Synonyms: 1- (2,3- dihydro- 1,4- benzodioxin- 6- yl)- 5- imino- 4- (4- methyl- 1,3- thiazol- 2- yl)- 2,5- dihydro- 1H- pyrrol- 3- ol
Smiles: Cc1csc(n1)C1=C(O)CN(C1=N)c1ccc2c(c1)OCCO2

STK630554
Synonyms: 6- bromo- 4- oxo- N- {4- [4- (propan- 2- yl)phenyl]- 1,2,5- oxadiazol- 3- yl}- 4H- chromene- 2- carboxamide
Smiles: Brc1ccc2c(c1)c(=O)cc(o2)C(=O)Nc1nonc1c1ccc(cc1)C(C)C

STK630558
Synonyms: N- (1,3- benzodioxol- 5- ylmethyl)- 2- (1H- pyrrol- 1- yl)- 1,3- benzothiazole- 6- carboxamide
Smiles: O=C(c1ccc2c(c1)sc(n2)n1cccc1)NCc1ccc2c(c1)OCO2

STK857148
Synonyms: (2Z)- 2- (2- methylbenzylidene)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yldimethylcarbamate
Smiles: O=C(N(C)C)Oc1ccc2c(c1)O/C(=C\c1ccccc1C)/C2=O

STK630561
Synonyms: (4Z)- 4- (1- hydroxyethylidene)- 1- (hydroxymethyl)- 5- (4- methoxyphenyl)pyrrolidine- 2,3- dione
Smiles: COc1ccc(cc1)C1/C(=C(/O)\C)/C(=O)C(=O)N1CO

STK857149
Synonyms: methyl{[(2Z)- 2- (4- bromobenzylidene)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl]oxy}acetate
Smiles: COC(=O)COc1ccc2c(c1)O/C(=C\c1ccc(cc1)Br)/C2=O

STK630564
Synonyms: N- {(2S)- 4- (methylsulfanyl)- 1- oxo- 1- [(pyridin- 3- ylmethyl)amino]butan- 2- yl}- 1- (phenylsulfonyl)piperidine- 3- carboxamide
Smiles: CSCC[C@@H](C(=O)NCc1cccnc1)NC(=O)C1CCCN(C1)S(=O)(=O)c1ccccc1

STK630565
Synonyms: (2E)- 2- [(1- ethyl- 5- methoxy- 1H- indol- 3- yl)methylidene]- 7- methyl- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl4- methylbenzoate
Smiles: COc1ccc2c(c1)c(/C=C\1/Oc3c(C1=O)ccc(c3C)OC(=O)c1ccc(cc1)C)cn2CC

STK630568
Synonyms: N- [2- (5- fluoro- 1H- indol- 3- yl)ethyl]- 4- (4- oxo- 1,2,3- benzotriazin- 3(4H)- yl)butanamide
Smiles: O=C(CCCn1nnc2c(c1=O)cccc2)NCCc1c[nH]c2c1cc(F)cc2

STK630569
Synonyms: 2- hydroxy- 5- (3- methoxyphenyl)- 1- methylpyrido[2,3- d]pyrimidin- 4(1H)- one
Smiles: COc1cccc(c1)c1ccnc2c1c(=O)nc(n2C)O

STK857150
Synonyms: (2Z)- 8- (pyridin- 3- ylmethyl)- 2- (pyridin- 3- ylmethylidene)- 8,9- dihydro- 7H- furo[2,3- f][1,3]benzoxazin- 3(2H)- one
Smiles: O=C1/C(=C/c2cccnc2)/Oc2c1ccc1c2CN(CO1)Cc1cccnc1

STK630570
Synonyms: N~2~- [(4- hydroxyphthalazin- 1- yl)acetyl]- N- [(3- phenyl- 1,2,4- oxadiazol- 5- yl)methyl]alaninamide
Smiles: O=C(Cc1nnc(c2c1cccc2)O)NC(C(=O)NCc1onc(n1)c1ccccc1)C

STK630575
Synonyms: 4- oxo- 4- {(pyridin- 4- ylmethyl)[2- (pyrrolidin- 1- ylsulfonyl)ethyl]amino}butanoicacid
Smiles: OC(=O)CCC(=O)N(Cc1ccncc1)CCS(=O)(=O)N1CCCC1

STK630578
Synonyms: (2E)- 2- [(1- ethyl- 5- methoxy- 1H- indol- 3- yl)methylidene]- 7- methyl- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl3- methoxybenzoate
Smiles: COc1cccc(c1)C(=O)Oc1ccc2c(c1C)O/C(=C/c1cn(c3c1cc(OC)cc3)CC)/C2=O

STK630579
Synonyms: 4- (2,3- dihydro- 1,4- benzodioxin- 6- ylsulfonyl)- N- [2- (morpholin- 4- yl)ethyl]- 2- phenyl- 1,3- oxazol- 5- amine
Smiles: O=S(=O)(c1nc(oc1NCCN1CCOCC1)c1ccccc1)c1ccc2c(c1)OCCO2

STK630580
Synonyms: N~3~- (2- chloro- 7H- purin- 6- yl)- N- [3- (dimethylamino)propyl]- beta- alaninamide
Smiles: CN(CCCNC(=O)CCNc1nc(Cl)nc2c1[nH]cn2)C

STK630582
Synonyms: N- {[4- (1H- indol- 3- ylcarbonyl)piperazin- 1- yl]carbonyl}- L- phenylalanine
Smiles: O=C(N1CCN(CC1)C(=O)c1c[nH]c2c1cccc2)N[C@H](C(=O)O)Cc1ccccc1

STK630583
Synonyms: methyl[(7- hydroxy- 5- phenyl[1,2,4]triazolo[1,5- a]pyrimidin- 2- yl)sulfanyl]acetate
Smiles: COC(=O)CSc1nn2c(n1)nc(cc2O)c1ccccc1

STK630586
Synonyms: 3- (3- tert- butyl[1,2,4]triazolo[3,4- b][1,3,4]thiadiazol- 6- yl)- 1H- indole
Smiles: CC(c1nnc2n1nc(s2)c1c[nH]c2c1cccc2)(C)C

STK630587
Synonyms: methylN- {[4- (1H- indol- 2- ylcarbonyl)piperazin- 1- yl]carbonyl}- L- valinate
Smiles: COC(=O)[C@H](C(C)C)NC(=O)N1CCN(CC1)C(=O)c1cc2c([nH]1)cccc2

STK630589
Synonyms: (2Z)- 2- (4- tert- butylbenzylidene)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl(2E)- 3- phenylprop- 2- enoate
Smiles: O=C(Oc1ccc2c(c1)O/C(=C\c1ccc(cc1)C(C)(C)C)/C2=O)/C=C/c1ccccc1

STK630590
Synonyms: 5- imino- 4- (4- methyl- 1,3- thiazol- 2- yl)- 1- {[(E)- pyridin- 4- ylmethylidene]amino}- 2,5- dihydro- 1H- pyrrol- 3- ol
Smiles: Cc1csc(n1)C1=C(O)CN(C1=N)/N=C/c1ccncc1

STK630595
Synonyms: N- [2- (5- chloro- 1H- indol- 3- yl)ethyl]- 2- (4- hydroxyphthalazin- 1- yl)acetamide
Smiles: O=C(Cc1nnc(c2c1cccc2)O)NCCc1c[nH]c2c1cc(Cl)cc2

STK630596
Synonyms: N- (3- chlorophenyl)- N~2~- (2- chloro- 7H- purin- 6- yl)glycinamide
Smiles: O=C(Nc1cccc(c1)Cl)CNc1nc(Cl)nc2c1[nH]cn2

STK630597
Synonyms: 6- nitro- 2- oxo- 1- [5- oxo- 5- (pyridin- 3- yl)pentyl]- 1,2,3,4- tetrahydroquinoline- 3- carboxylicacid
Smiles: OC(=O)C1Cc2cc(ccc2N(C1=O)CCCCC(=O)c1cccnc1)[N+](=O)[O-]

STK630598
Synonyms: 6- chloro- 7- hydroxy- 5- methylpyrazolo[1,5- a]pyrimidine- 3- carbonitrile
Smiles: N#Cc1cnn2c1nc(C)c(c2O)Cl

STK630600
Synonyms: 3- methylbutyl{[3- (2- methoxyphenyl)- 4- oxo- 4H- chromen- 7- yl]oxy}acetate
Smiles: COc1ccccc1c1coc2c(c1=O)ccc(c2)OCC(=O)OCCC(C)C

STK630601
Synonyms: methyl5- hydroxy- 4- (3- methoxyphenyl)- 2- methyl- 4H- indeno[1,2- b]pyridine- 3- carboxylate
Smiles: COc1cccc(c1)C1C(=C(C)N=C2C1=C(O)c1c2cccc1)C(=O)OC

STK630604
Synonyms: 4- (2,3- dihydro- 1,4- benzodioxin- 6- ylsulfonyl)- 2- (furan- 2- yl)- N- [2- (morpholin- 4- yl)ethyl]- 1,3- oxazol- 5- amine
Smiles: O=S(=O)(c1nc(oc1NCCN1CCOCC1)c1ccco1)c1ccc2c(c1)OCCO2

STK857153
Synonyms: methyl4- {(Z)- [6- {[(4- fluorophenyl)sulfonyl]oxy}- 3- oxo- 1- benzofuran- 2(3H)- ylidene]methyl}benzoate
Smiles: COC(=O)c1ccc(cc1)/C=C/1\Oc2c(C1=O)ccc(c2)OS(=O)(=O)c1ccc(cc1)F

STK630607
Synonyms: methyl6- (2- hydroxy- 4- oxoquinazolin- 3(4H)- yl)hexanoate
Smiles: COC(=O)CCCCCn1c(O)nc2c(c1=O)cccc2

STK630609
Synonyms: N~6~- (2- chlorobenzyl)- 7H- purine- 2,6- diamine
Smiles: Nc1nc(NCc2ccccc2Cl)c2c(n1)nc[nH]2

STK630614
Synonyms: 3- (5- bromopyridin- 3- yl)- 6- (3- chlorophenyl)[1,2,4]triazolo[3,4- b][1,3,4]thiadiazole
Smiles: Clc1cccc(c1)c1sc2n(n1)c(nn2)c1cncc(c1)Br

STK630615
Synonyms: N- cyclohexyl- 2- (6- ethyl- 5- methyl- 4- oxothieno[2,3- d][1,2,3]triazin- 3(4H)- yl)acetamide
Smiles: CCc1sc2c(c1C)c(=O)n(nn2)CC(=O)NC1CCCCC1

STK630619
Synonyms: 1- (6- methoxy- 1- propyl- 1H- indol- 3- yl)propan- 2- amine
Smiles: CCCn1cc(c2c1cc(OC)cc2)CC(N)C

STK630621
Synonyms: 3- (4- chlorophenyl)- 7- hydroxy- 8- (piperidin- 1- ylmethyl)- 4H- chromen- 4- one
Smiles: Clc1ccc(cc1)c1coc2c(c1=O)ccc(c2CN1CCCCC1)O

STK630623
Synonyms: 3,4- dimethyl- 9,10- dihydrocyclopenta[c]furo[2,3- f]chromene- 7(8H)- thione
Smiles: S=c1oc2cc(C)c3c(c2c2c1CCC2)occ3C

STK630625
Synonyms: 3- [(10- methyl- 8,9,10,11- tetrahydro[1]benzothieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 5- yl)amino]propan- 1- ol
Smiles: OCCCNc1nc2sc3c(c2c2n1ncn2)CC(CC3)C

STK630627
Synonyms: N- (propan- 2- yl)- 2- (1H- pyrrol- 1- yl)- 1,3- benzothiazole- 6- carboxamide
Smiles: CC(NC(=O)c1ccc2c(c1)sc(n2)n1cccc1)C

STK630630
Synonyms: (5E)- 5- [(6- methoxy- 1H- indol- 3- yl)methylidene]- 3- methyl- 2- thioxo- 1,3- thiazolidin- 4- one
Smiles: COc1ccc2c(c1)[nH]cc2/C=C\1/SC(=S)N(C1=O)C

STK630631
Synonyms: 4- (2,3- dihydro- 1,4- benzodioxin- 6- ylsulfonyl)- 2- (4- fluorophenyl)- N,N- dimethyl- 1,3- oxazol- 5- amine
Smiles: Fc1ccc(cc1)c1oc(c(n1)S(=O)(=O)c1ccc2c(c1)OCCO2)N(C)C

STK630632
Synonyms: 4- (2,3- dihydro- 1,4- benzodioxin- 6- ylsulfonyl)- 2- (3,4- dimethoxyphenyl)- 5- (pyrrolidin- 1- yl)- 1,3- oxazole
Smiles: COc1ccc(cc1OC)c1oc(c(n1)S(=O)(=O)c1ccc2c(c1)OCCO2)N1CCCC1

STK630634
Synonyms: ethyl{(2Z)- 2- [(1- benzofuran- 2- ylcarbonyl)imino]- 2,3- dihydro- 1,3- thiazol- 4- yl}acetate
Smiles: CCOC(=O)Cc1cs/c(=N\C(=O)c2cc3c(o2)cccc3)/[nH]1

STK630635
Synonyms: (2Z)- 8- (pyridin- 2- ylmethyl)- 2- (2,3,4- trimethoxybenzylidene)- 8,9- dihydro- 7H- furo[2,3- f][1,3]benzoxazin- 3(2H)- one
Smiles: COc1c(ccc(c1OC)OC)/C=C/1\Oc2c(C1=O)ccc1c2CN(CO1)Cc1ccccn1

STK630636
Synonyms: 3- (3- chloro- 1,2- oxazol- 5- yl)- N- [3- methyl- 2- (phenylcarbonyl)- 1- benzofuran- 6- yl]propanamide
Smiles: O=C(Nc1ccc2c(c1)oc(c2C)C(=O)c1ccccc1)CCc1onc(c1)Cl

STK630637
Synonyms: N- (2,3- dihydroxypropyl)- 1- (pyrimidin- 2- yl)piperidine- 3- carboxamide
Smiles: OCC(CNC(=O)C1CCCN(C1)c1ncccn1)O

STK630643
Synonyms: N- (2,4- dimethoxyphenyl)- 2- {[3- (4- methoxyphenyl)- 2- methyl- 4- oxo- 4H- chromen- 7- yl]oxy}acetamide
Smiles: COc1ccc(cc1)c1c(C)oc2c(c1=O)ccc(c2)OCC(=O)Nc1ccc(cc1OC)OC

STK630646
Synonyms: 3- {3- [4- (2- methoxyphenyl)piperazin- 1- yl]- 3- oxopropyl}quinazolin- 4(3H)- one
Smiles: COc1ccccc1N1CCN(CC1)C(=O)CCn1cnc2c(c1=O)cccc2

STK630647
Synonyms: (2Z)- 2- (2,4- dimethoxybenzylidene)- 8- (furan- 2- ylmethyl)- 8,9- dihydro- 7H- furo[2,3- f][1,3]benzoxazin- 3(2H)- one
Smiles: COc1cc(OC)ccc1/C=C/1\Oc2c(C1=O)ccc1c2CN(CO1)Cc1ccco1

STK630649
Synonyms: ethyl4- {[1- (9H- purin- 6- yl)piperidin- 4- yl]carbonyl}piperazine- 1- carboxylate
Smiles: CCOC(=O)N1CCN(CC1)C(=O)C1CCN(CC1)c1ncnc2c1nc[nH]2

STK630650
Synonyms: 2- (3,4- dimethoxybenzyl)- 7- (3- methoxyphenyl)- 8,9- dimethyl- 7H- pyrrolo[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: COc1cccc(c1)n1c2ncn3c(c2c(c1C)C)nc(n3)Cc1ccc(c(c1)OC)OC

STK630651
Synonyms: N- (1H- benzimidazol- 2- yl)- 2- (2- hydroxy- 4- oxoquinazolin- 3(4H)- yl)- 3- methylbutanamide
Smiles: CC(C(n1c(O)nc2c(c1=O)cccc2)C(=O)Nc1nc2c([nH]1)cccc2)C

STK630652
Synonyms: 6- (5- bromopyridin- 3- yl)- 3- (3- fluorophenyl)[1,2,4]triazolo[3,4- b][1,3,4]thiadiazole
Smiles: Fc1cccc(c1)c1nnc2n1nc(s2)c1cncc(c1)Br

STK630653
Synonyms: N- [2- hydroxy- 5- oxo- 1- (pyridin- 3- ylmethyl)- 4- (trifluoromethyl)- 4,5- dihydro- 1H- imidazol- 4- yl]thiophene- 2- carboxamide
Smiles: OC1=NC(C(=O)N1Cc1cccnc1)(NC(=O)c1cccs1)C(F)(F)F

STK630655
Synonyms: 4- (1,3- benzodioxol- 5- ylmethyl)- 5- (2- hydroxyphenyl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: Oc1ccccc1c1n[nH]c(=S)n1Cc1ccc2c(c1)OCO2

STK630656
Synonyms: (2Z)- 2- (2- methylbenzylidene)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl4- chlorobenzenesulfonate
Smiles: Clc1ccc(cc1)S(=O)(=O)Oc1ccc2c(c1)O/C(=C\c1ccccc1C)/C2=O

STK630657
Synonyms: 1- methyltetrahydro- 1H- thieno[3,4- d]imidazole- 2(3H)- thione5,5- dioxide
Smiles: CN1C(=S)NC2C1CS(=O)(=O)C2

STK630658
Synonyms: (2Z)- 2- (4- methoxybenzylidene)- 8- (pyridin- 4- ylmethyl)- 8,9- dihydro- 7H- furo[2,3- f][1,3]benzoxazin- 3(2H)- one
Smiles: COc1ccc(cc1)/C=C/1\Oc2c(C1=O)ccc1c2CN(CO1)Cc1ccncc1

STK630659
Synonyms: ethyl3- [4- hydroxy- 6- methyl- 2- (4- methylpiperazin- 1- yl)pyrimidin- 5- yl]propanoate
Smiles: CCOC(=O)CCc1c(C)nc(nc1O)N1CCN(CC1)C

STK630662
Synonyms: N- (furan- 2- ylmethyl)- 3- {(4S)- 1- [2- (4- methoxyphenyl)ethyl]- 2,5- dioxoimidazolidin- 4- yl}propanamide
Smiles: COc1ccc(cc1)CCN1C(=O)N[C@H](C1=O)CCC(=O)NCc1ccco1

STK630664
Synonyms: 3- (7- methoxy- 4,8- dimethyl- 2- oxo- 2H- chromen- 3- yl)- N- [3- (morpholin- 4- yl)propyl]propanamide
Smiles: COc1ccc2c(c1C)oc(=O)c(c2C)CCC(=O)NCCCN1CCOCC1

STK630666
Synonyms: tert- butyl{[(2Z)- 2- (2- chlorobenzylidene)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl]oxy}acetate
Smiles: O=C(OC(C)(C)C)COc1ccc2c(c1)O/C(=C\c1ccccc1Cl)/C2=O

STK630667
Synonyms: 5- (4- methoxyphenyl)- 4- [3- (morpholin- 4- yl)propyl]- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: COc1ccc(cc1)c1n[nH]c(=S)n1CCCN1CCOCC1

STK630668
Synonyms: 2- hydroxy- 5- (2- methoxyphenyl)- 1- (tetrahydrofuran- 2- ylmethyl)pyrido[2,3- d]pyrimidin- 4(1H)- one
Smiles: COc1ccccc1c1ccnc2c1c(=O)nc(n2CC1CCCO1)O

STK630670
Synonyms:
Smiles: CCC([C@@H](C(=O)O)NS(=O)(=O)c1ccc(cc1)F)C

STK857161
Synonyms: 3- (2- methoxyphenoxy)- 2- methyl- 4- oxo- 4H- chromen- 7- yldimethylcarbamate
Smiles: COc1ccccc1Oc1c(C)oc2c(c1=O)ccc(c2)OC(=O)N(C)C

STK630672
Synonyms: N- cyclopentyl- N~2~- [(4- hydroxyphthalazin- 1- yl)acetyl]glycinamide
Smiles: O=C(Cc1nnc(c2c1cccc2)O)NCC(=O)NC1CCCC1

STK630674
Synonyms: N~6~- [3- (trifluoromethyl)phenyl]- 7H- purine- 2,6- diamine
Smiles: Nc1nc(Nc2cccc(c2)C(F)(F)F)c2c(n1)nc[nH]2

STK630675
Synonyms: 3- [(3- phenoxybenzyl)sulfanyl]- 6- phenyl- 1,2,4- triazin- 5- ol
Smiles: Oc1nc(SCc2cccc(c2)Oc2ccccc2)nnc1c1ccccc1

STK630677
Synonyms: {(5E)- 5- [(6- methoxyquinolin- 2- yl)methylidene]- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl}(phenyl)aceticacid
Smiles: COc1ccc2c(c1)ccc(n2)/C=C\1/SC(=S)N(C1=O)C(c1ccccc1)C(=O)O

STK630679
Synonyms: (2Z)- 2- [(2E)- 3- (2- methoxyphenyl)prop- 2- en- 1- ylidene]- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- ylbenzenesulfonate
Smiles: COc1ccccc1/C=C/C=C/1\Oc2c(C1=O)ccc(c2)OS(=O)(=O)c1ccccc1

STK630681
Synonyms: (2Z)- 2- (2,5- dimethoxybenzylidene)- 8- (tetrahydrofuran- 2- ylmethyl)- 8,9- dihydro- 7H- furo[2,3- f][1,3]benzoxazin- 3(2H)- one
Smiles: COc1ccc(cc1/C=C/1\Oc2c(C1=O)ccc1c2CN(CO1)CC1CCCO1)OC

STK630683
Synonyms: N- (furan- 2- ylmethyl)- 1- (1H- indol- 2- ylcarbonyl)piperidine- 3- carboxamide
Smiles: O=C(C1CCCN(C1)C(=O)c1cc2c([nH]1)cccc2)NCc1ccco1

STK630684
Synonyms: ethyl[(6- methyl- 2H- pyrazolo[3,4- b]pyridin- 3- yl)amino](oxo)acetate
Smiles: CCOC(=O)C(=O)Nc1[nH]nc2c1ccc(n2)C

STK630685
Synonyms: 5- ethyl- 7- {[4- (pyridin- 2- yl)piperazin- 1- yl]carbonyl}[1,3]dioxolo[4,5- g]quinolin- 8(5H)- one
Smiles: CCn1cc(C(=O)N2CCN(CC2)c2ccccn2)c(=O)c2c1cc1OCOc1c2

STK630687
Synonyms: 3,3- dimethyl- 6- {4- [morpholin- 4- yl(oxo)acetyl]piperazin- 1- yl}- 8- phenyl- 3,4- dihydro- 1H- pyrano[3,4- c]pyridine- 5- carbonitrile
Smiles: N#Cc1c(nc(c2c1CC(C)(C)OC2)c1ccccc1)N1CCN(CC1)C(=O)C(=O)N1CCOCC1

STK630688
Synonyms: 4- (4- hydroxy- 3,5- dimethoxyphenyl)- 3,7,7- trimethyl- 4,6,7,8- tetrahydro[1,2]oxazolo[5,4- b]quinolin- 5- ol
Smiles: COc1cc(cc(c1O)OC)C1C2=C(O)CC(CC2=Nc2c1c(C)no2)(C)C

STK630691
Synonyms: (2E)- 6- [(2,6- dichlorobenzyl)oxy]- 2- [(5- methoxy- 1- methyl- 1H- indol- 3- yl)methylidene]- 7- methyl- 1- benzofuran- 3(2H)- one
Smiles: COc1ccc2c(c1)c(/C=C\1/Oc3c(C1=O)ccc(c3C)OCc1c(Cl)cccc1Cl)cn2C

STK630692
Synonyms: (3Z)- 6- chloro- 1- [(dimethylamino)methyl]- 3- (furan- 2- ylmethylidene)- 1,3- dihydro- 2H- indol- 2- one
Smiles: CN(CN1C(=O)/C(=C\c2ccco2)/c2c1cc(Cl)cc2)C

STK630693
Synonyms: 4- (2,3- dihydro- 1,4- benzodioxin- 6- ylsulfonyl)- 2- (furan- 2- yl)- N- (propan- 2- yl)- 1,3- oxazol- 5- amine
Smiles: CC(Nc1oc(nc1S(=O)(=O)c1ccc2c(c1)OCCO2)c1ccco1)C

STK857162
Synonyms: 3- (3,4- dihydro- 2H- 1,5- benzodioxepin- 7- yl)- 2- methyl- 4- oxo- 4H- chromene- 5,7- diyldiacetate
Smiles: CC(=O)Oc1cc(OC(=O)C)cc2c1c(=O)c(c(o2)C)c1ccc2c(c1)OCCCO2

STK630696
Synonyms: (2Z)- 8- (2,4- dimethoxyphenyl)- 2- (pyridin- 3- ylmethylidene)- 8,9- dihydro- 7H- furo[2,3- f][1,3]benzoxazin- 3(2H)- one
Smiles: COc1cc(OC)ccc1N1COc2c(C1)c1O/C(=C\c3cccnc3)/C(=O)c1cc2

STK630699
Synonyms: 2- {(5Z)- 5- [(5- methoxy- 1,2- dimethyl- 1H- indol- 3- yl)methylidene]- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl}- 3- methylbutanoicacid
Smiles: COc1ccc2c(c1)c(/C=C/1\SC(=S)N(C1=O)C(C(=O)O)C(C)C)c(n2C)C

STK630701
Synonyms: 4- [4- (4- chlorophenyl)- 1,3- thiazol- 2- yl]- 1- {[(E)- (1,3- dimethyl- 1H- pyrazol- 4- yl)methylidene]amino}- 5- imino- 2,5- dihydro- 1H- pyrrol- 3- ol
Smiles: Clc1ccc(cc1)c1csc(n1)C1=C(O)CN(C1=N)/N=C/c1cn(nc1C)C

STK630703
Synonyms: 2- [(2- chloro- 7H- purin- 6- yl)sulfanyl]- N- (4- methoxybenzyl)acetamide
Smiles: COc1ccc(cc1)CNC(=O)CSc1nc(Cl)nc2c1[nH]cn2

STK630704
Synonyms: N- (3,4- dichlorophenyl)- 1- (9H- purin- 6- yl)piperidine- 4- carboxamide
Smiles: O=C(C1CCN(CC1)c1ncnc2c1nc[nH]2)Nc1ccc(c(c1)Cl)Cl

STK630705
Synonyms: (5Z)- 5- {[(1,1- dioxidotetrahydrothiophen- 3- yl)(ethyl)amino]methylidene}- 3- (2- methylpropyl)- 2- thioxo- 1,3- thiazolidin- 4- one
Smiles: CCN(C1CCS(=O)(=O)C1)/C=C/1\SC(=S)N(C1=O)CC(C)C

STK630707
Synonyms: 7- (4- methoxyphenyl)- 5,6- dimethyl- N- (pyridin- 4- ylmethyl)- 7H- pyrrolo[2,3- d]pyrimidin- 4- amine
Smiles: COc1ccc(cc1)n1c(C)c(c2c1ncnc2NCc1ccncc1)C

STK857163
Synonyms: ethyl3- (4- bromophenyl)- 7- methoxy- 4- oxo- 4H- chromene- 2- carboxylate
Smiles: CCOC(=O)c1oc2cc(OC)ccc2c(=O)c1c1ccc(cc1)Br

STK630709
Synonyms: 3- (piperazin- 1- yl)- 4,5- dihydro- 3H- 1- benzazepin- 2- ol
Smiles: OC1=Nc2ccccc2CCC1N1CCNCC1

STK630711
Synonyms: 2- amino- 7- hydroxy- 4- (3- methoxyphenyl)[1,3]thiazolo[4,5- d]pyrimidin- 5(4H)- one
Smiles: COc1cccc(c1)n1c(=O)nc(c2c1nc(s2)N)O

STK630718
Synonyms: N- [4- (3- ethyl- 2- hydroxy- 6- oxo- 3,4,5,6- tetrahydropyridin- 3- yl)phenyl]- 4- (1H- indol- 3- yl)butanamide
Smiles: CCC1(CCC(=O)N=C1O)c1ccc(cc1)NC(=O)CCCc1c[nH]c2c1cccc2

STK630720
Synonyms: 5- imino- 1- (2- methylpropyl)- 4- (4- phenyl- 1,3- thiazol- 2- yl)- 2,5- dihydro- 1H- pyrrol- 3- ol
Smiles: CC(CN1CC(=C(C1=N)c1scc(n1)c1ccccc1)O)C

STK630721
Synonyms: (5E)- 5- [(6- hydroxy[1,3]dioxolo[4,5- g]quinolin- 7- yl)methylidene]- 2- (pyridin- 3- ylamino)- 1,3- thiazol- 4(5H)- one
Smiles: O=C1N=C(S/C/1=C/c1cc2cc3OCOc3cc2nc1O)Nc1cccnc1

STK630724
Synonyms: (2Z)- 2- (4- bromobenzylidene)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- ylbenzenesulfonate
Smiles: Brc1ccc(cc1)/C=C/1\Oc2c(C1=O)ccc(c2)OS(=O)(=O)c1ccccc1

STK630726
Synonyms: 2- [(4- methoxybenzyl)amino]- 8- methyl- 4- phenyl- 4,9- dihydro- 6H- pyrimido[1,2- a][1,3,5]triazin- 6- one
Smiles: COc1ccc(cc1)CNC1=NC(c2ccccc2)n2c(=N1)[nH]c(cc2=O)C

STK630728
Synonyms: 2- (3,4- dimethoxyphenyl)- N- methyl- 6,7- dihydro[1,3]thiazolo[5,4- c]pyridine- 5(4H)- carbothioamide
Smiles: CNC(=S)N1CCc2c(C1)sc(n2)c1ccc(c(c1)OC)OC

STK630729
Synonyms: 4- {[(2,3- dioxo- 2,3- dihydro- 1H- indol- 1- yl)methyl]amino}benzoicacid
Smiles: O=C1C(=O)c2c(N1CNc1ccc(cc1)C(=O)O)cccc2

STK630730
Synonyms: 2- (4- methoxyphenoxy)- N- [4- (5,6,7,8- tetrahydronaphthalen- 2- yl)- 1,2,5- oxadiazol- 3- yl]acetamide
Smiles: COc1ccc(cc1)OCC(=O)Nc1nonc1c1ccc2c(c1)CCCC2

STK630731
Synonyms: N- acetyl- S- (2- chloro- 7H- purin- 6- yl)cysteine
Smiles: CC(=O)NC(C(=O)O)CSc1nc(Cl)nc2c1[nH]cn2

STK630732
Synonyms: (2Z)- 2- (4- chlorobenzylidene)- 6- [(3- methylbut- 2- en- 1- yl)oxy]- 1- benzofuran- 3(2H)- one
Smiles: CC(=CCOc1ccc2c(c1)O/C(=C\c1ccc(cc1)Cl)/C2=O)C

STK857164
Synonyms: 5- amino- 1- (4- fluorophenyl)- N- (2- phenylethyl)- 1H- 1,2,3- triazole- 4- carboxamide
Smiles: Fc1ccc(cc1)n1nnc(c1N)C(=O)NCCc1ccccc1

STK630734
Synonyms: N- [2- oxo- 2- ({[trans- 4- ({4- [2- (pyridin- 4- yl)ethyl]piperazin- 1- yl}carbonyl)cyclohexyl]methyl}amino)ethyl]benzamide
Smiles: O=C(CNC(=O)c1ccccc1)NC[C@@H]1CC[C@H](CC1)C(=O)N1CCN(CC1)CCc1ccncc1

STK857165
Synonyms: 2- ({[1- (4- fluorophenyl)- 1H- tetrazol- 5- yl]methyl}sulfanyl)- 6- methylpyrimidin- 4- ol
Smiles: Fc1ccc(cc1)n1nnnc1CSc1nc(C)cc(n1)O

STK630738
Synonyms: (2Z)- 2- (2- ethoxybenzylidene)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl4- methoxybenzenesulfonate
Smiles: CCOc1ccccc1/C=C/1\Oc2c(C1=O)ccc(c2)OS(=O)(=O)c1ccc(cc1)OC

STK630740
Synonyms: trans- N- [2- (3,4- dihydroisoquinolin- 2(1H)- yl)- 2- oxoethyl]- 4- ({[(4- methylphenyl)sulfonyl]amino}methyl)cyclohexanecarboxamide
Smiles: O=C([C@@H]1CC[C@H](CC1)CNS(=O)(=O)c1ccc(cc1)C)NCC(=O)N1CCc2c(C1)cccc2

STK630742
Synonyms: (3- bromophenyl)[1- (3,4- diethoxybenzyl)- 6,7- diethoxy- 3,4- dihydroisoquinolin- 2(1H)- yl]methanone
Smiles: CCOc1cc(ccc1OCC)CC1N(CCc2c1cc(OCC)c(c2)OCC)C(=O)c1cccc(c1)Br

STK630743
Synonyms: 2- [(3- benzyl- 4,8- dimethyl- 2- oxo- 2H- chromen- 7- yl)oxy]- N- (pyridin- 4- ylmethyl)acetamide
Smiles: O=C(COc1ccc2c(c1C)oc(=O)c(c2C)Cc1ccccc1)NCc1ccncc1

STK630746
Synonyms: N- {3- [(1E)- 1- hydrazinylideneethyl]phenyl}- 2- [3- hydroxy- 4- (3- methyl- 4- phenoxy- 1H- pyrazol- 5- yl)phenoxy]acetamide
Smiles: N/N=C(/c1cccc(c1)NC(=O)COc1ccc(c(c1)O)c1[nH]nc(c1Oc1ccccc1)C)\C

STK630747
Synonyms: 7- chloro- 2- methyl- 4- (pyridin- 3- ylmethyl)- 4H- [1,3]thiazolo[5,4- b]indole
Smiles: Clc1ccc2c(c1)c1nc(sc1n2Cc1cccnc1)C

STK630752
Synonyms: 3- amino- N- [(2Z)- 1,3- benzothiazol- 2(3H)- ylidene]thieno[2,3- b]pyridine- 2- carboxamide
Smiles: O=C(c1sc2c(c1N)cccn2)/N=c/1\sc2c([nH]1)cccc2

STK630755
Synonyms: (2Z)- 2- (4- fluorobenzylidene)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yldiphenylcarbamate
Smiles: Fc1ccc(cc1)/C=C/1\Oc2c(C1=O)ccc(c2)OC(=O)N(c1ccccc1)c1ccccc1

STK630756
Synonyms: (2E)- 6- [(4- bromobenzyl)oxy]- 7- methyl- 2- [(1- methyl- 1H- indol- 3- yl)methylidene]- 1- benzofuran- 3(2H)- one
Smiles: Brc1ccc(cc1)COc1ccc2c(c1C)O/C(=C/c1cn(c3c1cccc3)C)/C2=O

STK630757
Synonyms: 4- (1,3- benzothiazol- 2- yl)- 5- imino- 1- {[(E)- pyridin- 3- ylmethylidene]amino}- 2,5- dihydro- 1H- pyrrol- 3- ol
Smiles: OC1=C(c2nc3c(s2)cccc3)C(=N)N(C1)/N=C/c1cccnc1

STK630758
Synonyms: 3- (3,4- dimethoxyphenyl)- N- (2- {[(1,3- dimethyl- 2,6- dioxo- 1,2,3,6- tetrahydropyrimidin- 4- yl)methyl]amino}- 2- oxoethyl)propanamide
Smiles: COc1ccc(cc1OC)CCC(=O)NCC(=O)NCc1cc(=O)n(c(=O)n1C)C

STK630761
Synonyms: N~6~- (3- chlorophenyl)- 7H- purine- 2,6- diamine
Smiles: Clc1cccc(c1)Nc1nc(N)nc2c1[nH]cn2

STK630762
Synonyms: 4- {[(2- chloro- 7H- purin- 6- yl)amino]methyl}benzenesulfonamide
Smiles: Clc1nc(NCc2ccc(cc2)S(=O)(=O)N)c2c(n1)nc[nH]2

STK630763
Synonyms: 2- (4,5- dimethoxy- 3- oxo- 1,3- dihydro- 2- benzofuran- 1- yl)- N- (5- methyl- 1,3- thiazol- 2- yl)acetamide
Smiles: COc1c(OC)ccc2c1C(=O)OC2CC(=O)Nc1ncc(s1)C

STK630764
Synonyms: 3- (7- methoxy- 4- methyl- 2- oxo- 2H- chromen- 3- yl)- N- {[3- (4- methoxyphenyl)- 1,2,4- oxadiazol- 5- yl]methyl}propanamide
Smiles: COc1ccc(cc1)c1noc(n1)CNC(=O)CCc1c(=O)oc2c(c1C)ccc(c2)OC

STK630768
Synonyms: 5- (3,4- dimethoxyphenyl)- 4- [3- (morpholin- 4- yl)propyl]- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: COc1cc(ccc1OC)c1n[nH]c(=S)n1CCCN1CCOCC1

STK630772
Synonyms: [3- (1,3- benzodioxol- 5- yl)- 1,2,4- oxadiazol- 5- yl]acetonitrile
Smiles: N#CCc1onc(n1)c1ccc2c(c1)OCO2

STK630773
Synonyms: 4- (4- chlorophenyl)- 2- [(furan- 2- ylmethyl)amino]- 8- methyl- 4,9- dihydro- 6H- pyrimido[1,2- a][1,3,5]triazin- 6- one
Smiles: Clc1ccc(cc1)C1N=C(NCc2ccco2)N=c2n1c(=O)cc([nH]2)C

STK630775
Synonyms: [1- (2- amino- 2- oxoethyl)- 7- methyl- 2,4- dioxo- 1,4,5,6,7,8- hexahydro[1]benzothieno[2,3- d]pyrimidin- 3(2H)- yl]aceticacid
Smiles: CC1CCc2c(C1)sc1c2c(=O)n(c(=O)n1CC(=O)N)CC(=O)O

STK630777
Synonyms: (2Z)- 2- (1- benzofuran- 2- ylmethylidene)- 4- methyl- 7- (morpholin- 4- ium- 4- ylmethyl)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- olate
Smiles: Cc1cc([O-])c(c2c1C(=O)/C(=C/c1cc3c(o1)cccc3)/O2)C[NH+]1CCOCC1

STK630779
Synonyms: ethyl5- amino- 1- [3- (4- fluorophenyl)- 5- methyl- 2- (trifluoromethyl)pyrazolo[1,5- a]pyrimidin- 7- yl]- 1H- pyrazole- 4- carboxylate
Smiles: CCOC(=O)c1cnn(c1N)c1cc(C)nc2n1nc(c2c1ccc(cc1)F)C(F)(F)F

STK630780
Synonyms: N- [2- oxo- 2- (4- phenylpiperazin- 1- yl)ethyl]- 3- phenyl- 2,1- benzoxazole- 5- carboxamide
Smiles: O=C(N1CCN(CC1)c1ccccc1)CNC(=O)c1ccc2c(c1)c(on2)c1ccccc1

STK630784
Synonyms: 2- ({2- [(5E)- 5- (3- fluorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]propanoyl}amino)- 5- hydroxybenzoicacid
Smiles: Oc1ccc(c(c1)C(=O)O)NC(=O)C(N1C(=S)S/C(=C/c2cccc(c2)F)/C1=O)C

STK630786
Synonyms: 2- [(9- oxo- 1,2,3,9- tetrahydropyrrolo[2,1- b]quinazolin- 7- yl)oxy]- N- (4- phenoxyphenyl)acetamide
Smiles: O=C(Nc1ccc(cc1)Oc1ccccc1)COc1ccc2c(c1)c(=O)n1c(n2)CCC1

STK857167
Synonyms: tert- butyl{[(2Z)- 2- (4- methoxybenzylidene)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl]oxy}acetate
Smiles: COc1ccc(cc1)/C=C/1\Oc2c(C1=O)ccc(c2)OCC(=O)OC(C)(C)C

STK630788
Synonyms: (2Z)- 2- (2- bromobenzylidene)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl4- methoxybenzenesulfonate
Smiles: COc1ccc(cc1)S(=O)(=O)Oc1ccc2c(c1)O/C(=C\c1ccccc1Br)/C2=O

STK630790
Synonyms: 3- (4- methoxyphenyl)- 9- (pyridin- 3- yl)- 9,10- dihydro- 4H,8H- chromeno[8,7- e][1,3]oxazin- 4- one
Smiles: COc1ccc(cc1)c1coc2c(c1=O)ccc1c2CN(CO1)c1cccnc1

STK630791
Synonyms: trans- N- (2- hydroxy- 2- phenylethyl)- 4- ({[(4- methoxyphenyl)sulfonyl]amino}methyl)cyclohexanecarboxamide
Smiles: COc1ccc(cc1)S(=O)(=O)NC[C@@H]1CC[C@H](CC1)C(=O)NCC(c1ccccc1)O

STK630793
Synonyms: 5- (2- methoxyphenyl)- 2- phenyl[1,2,4]triazolo[1,5- a]pyrimidin- 7- ol
Smiles: COc1ccccc1c1cc(O)n2c(n1)nc(n2)c1ccccc1

STK630795
Synonyms: 2- chloro- N- [(1- ethylpyrrolidin- 2- yl)methyl]- 7H- purin- 6- amine
Smiles: CCN1CCCC1CNc1nc(Cl)nc2c1[nH]cn2

STK630805
Synonyms: 1- (1,1- dioxidotetrahydrothiophen- 3- yl)- N- (6- methylpyridin- 2- yl)- 4,5,6,7- tetrahydro- 1H- indazole- 3- carboxamide
Smiles: Cc1cccc(n1)NC(=O)c1nn(c2c1CCCC2)C1CCS(=O)(=O)C1

STK630807
Synonyms: (2E)- 2- (furan- 2- ylmethylidene)- 8- (2- phenylethyl)- 8,9- dihydro- 7H- furo[2,3- f][1,3]benzoxazin- 3(2H)- one
Smiles: O=C1/C(=C\c2ccco2)/Oc2c1ccc1c2CN(CO1)CCc1ccccc1

STK630810
Synonyms: N- [(2Z)- 3- [4- chloro- 3- (trifluoromethyl)phenyl]- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]- 2- cyanoacetamide
Smiles: N#CCC(=O)/N=C/1\SC2C(N1c1ccc(c(c1)C(F)(F)F)Cl)CS(=O)(=O)C2

STK630814
Synonyms: 5- imino- 1- [2- (morpholin- 4- yl)ethyl]- 4- (4- phenyl- 1,3- thiazol- 2- yl)- 2,5- dihydro- 1H- pyrrol- 3- ol
Smiles: OC1=C(c2scc(n2)c2ccccc2)C(=N)N(C1)CCN1CCOCC1

STK630816
Synonyms: diethyl{2- hydroxy- 5- [(E)- (4- methoxyphenyl)diazenyl]phenyl}phosphonate
Smiles: CCOP(=O)(c1cc(/N=N/c2ccc(cc2)OC)ccc1O)OCC

STK630817
Synonyms: 1- (biphenyl- 4- ylcarbonyl)- N- (pyridin- 4- yl)piperidine- 4- carboxamide
Smiles: O=C(c1ccc(cc1)c1ccccc1)N1CCC(CC1)C(=O)Nc1ccncc1

STK630819
Synonyms: 3- (3- chlorobenzyl)- 2- methylpyrimido[1,2- a]benzimidazol- 4- ol
Smiles: Clc1cccc(c1)Cc1c(C)nc2n(c1O)c1ccccc1n2

STK630820
Synonyms: 2- (4- hydroxyphthalazin- 1- yl)- N- (4- sulfamoylphenyl)acetamide
Smiles: O=C(Cc1nnc(c2c1cccc2)O)Nc1ccc(cc1)S(=O)(=O)N

STK630822
Synonyms: 2- (3- tert- butyl- 4,9- dimethyl- 7- oxo- 7H- furo[2,3- f]chromen- 8- yl)- N- (4- hydroxy- 1,1- dioxidotetrahydrothiophen- 3- yl)acetamide
Smiles: O=C(Cc1c(=O)oc2c(c1C)c1occ(c1c(c2)C)C(C)(C)C)NC1CS(=O)(=O)CC1O

STK630825
Synonyms: 3- (2- methoxybenzyl)tetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- imine5,5- dioxide
Smiles: COc1ccccc1CN1C(=N)SC2C1CS(=O)(=O)C2

STK630827
Synonyms: N- [2- (5- fluoro- 1H- indol- 3- yl)ethyl]- 1- (5- nitropyridin- 2- yl)piperidine- 3- carboxamide
Smiles: O=C(C1CCCN(C1)c1ccc(cn1)[N+](=O)[O-])NCCc1c[nH]c2c1cc(F)cc2

STK630831
Synonyms: 5- bromo- N- [2- (piperidin- 1- ylsulfonyl)ethyl]- N- (pyridin- 2- ylmethyl)furan- 2- carboxamide
Smiles: Brc1ccc(o1)C(=O)N(Cc1ccccn1)CCS(=O)(=O)N1CCCCC1

STK630832
Synonyms: 7- (5- bromopyridin- 2- yl)- 2- (4- fluorophenyl)- 8,9- dimethyl- 7H- pyrrolo[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: Fc1ccc(cc1)c1nc2n(n1)cnc1c2c(C)c(n1c1ccc(cn1)Br)C

STK857169
Synonyms: ethyl({(2Z)- 2- [(6- chloro- 4H- 1,3- benzodioxin- 8- yl)methylidene]- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl}oxy)acetate
Smiles: CCOC(=O)COc1ccc2c(c1)O/C(=C\c1cc(Cl)cc3c1OCOC3)/C2=O

STK630834
Synonyms: (2Z)- 2- (2- ethoxybenzylidene)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yldiphenylcarbamate
Smiles: CCOc1ccccc1/C=C/1\Oc2c(C1=O)ccc(c2)OC(=O)N(c1ccccc1)c1ccccc1

STK630839
Synonyms: N- (4- chloro- 3- nitrophenyl)- 5- oxo- 2,3,5,9b- tetrahydro[1,3]thiazolo[2,3- a]isoindole- 3- carboxamide
Smiles: O=C(C1CSC2N1C(=O)c1c2cccc1)Nc1ccc(c(c1)[N+](=O)[O-])Cl

STK630844
Synonyms: 2- methyl- 3- (morpholin- 4- ylcarbonyl)- 1,1- dioxido- 2H- 1,2- benzothiazin- 4- ylacetate
Smiles: CC(=O)OC1=C(C(=O)N2CCOCC2)N(C)S(=O)(=O)c2c1cccc2

STK630845
Synonyms: methyl6- amino- 4- (4- hydroxyphenyl)- 3- methyl- 2,4- dihydropyrano[2,3- c]pyrazole- 5- carboxylate
Smiles: COC(=O)C1=C(N)Oc2c(C1c1ccc(cc1)O)c(C)[nH]n2

STK630847
Synonyms: methyl2- ({[(2S)- 1- methoxy- 3- methyl- 1- oxobutan- 2- yl]carbamoyl}amino)benzoate
Smiles: COC(=O)[C@H](C(C)C)NC(=O)Nc1ccccc1C(=O)OC

STK630850
Synonyms: (2Z)- 8- [2- (morpholin- 4- yl)ethyl]- 2- (2,4,5- trimethoxybenzylidene)- 8,9- dihydro- 7H- furo[2,3- f][1,3]benzoxazin- 3(2H)- one
Smiles: COc1cc(OC)c(cc1/C=C/1\Oc2c(C1=O)ccc1c2CN(CCN2CCOCC2)CO1)OC

STK630851
Synonyms: 2- {[2- (5- butyl- 7- oxo- 7H- furo[3,2- g]chromen- 3- yl)ethyl]carbamoyl}benzoicacid
Smiles: CCCCc1cc(=O)oc2c1cc1c(CCNC(=O)c3ccccc3C(=O)O)coc1c2

STK630853
Synonyms: (2Z)- 2- (4- chlorobenzylidene)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl1,3- benzodioxole- 5- carboxylate
Smiles: Clc1ccc(cc1)/C=C/1\Oc2c(C1=O)ccc(c2)OC(=O)c1ccc2c(c1)OCO2

STK630855
Synonyms: 3- [(2- chloro- 7H- purin- 6- yl)amino]- 1- (4- methylpiperazin- 1- yl)propan- 1- one
Smiles: CN1CCN(CC1)C(=O)CCNc1nc(Cl)nc2c1[nH]cn2

STK630858
Synonyms: 4- [(2- chloro- 7H- purin- 6- yl)amino]- N- cyclopropylbutanamide
Smiles: O=C(NC1CC1)CCCNc1nc(Cl)nc2c1[nH]cn2

STK857170
Synonyms: methyl{4- [(Z)- (6- ethoxy- 3- oxo- 1- benzofuran- 2(3H)- ylidene)methyl]phenoxy}acetate
Smiles: CCOc1ccc2c(c1)O/C(=C\c1ccc(cc1)OCC(=O)OC)/C2=O

STK630863
Synonyms: (E)- 1- [(4- methylphenyl)sulfonyl]- N- [5- (propan- 2- yl)- 1,3,4- thiadiazol- 2(3H)- ylidene]prolinamide
Smiles: Cc1ccc(cc1)S(=O)(=O)N1CCCC1C(=O)/N=c/1\[nH]nc(s1)C(C)C

STK857171
Synonyms: 3- (3- methoxyphenoxy)- 9- (pyridin- 3- ylmethyl)- 2- (trifluoromethyl)- 9,10- dihydro- 4H,8H- chromeno[8,7- e][1,3]oxazin- 4- one
Smiles: COc1cccc(c1)Oc1c(=O)c2ccc3c(c2oc1C(F)(F)F)CN(CO3)Cc1cccnc1

STK630874
Synonyms: benzyl({(2E)- 2- [(5- methoxy- 1- methyl- 1H- indol- 3- yl)methylidene]- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl}oxy)acetate
Smiles: COc1ccc2c(c1)c(/C=C\1/Oc3c(C1=O)ccc(c3)OCC(=O)OCc1ccccc1)cn2C

STK630876
Synonyms: 1- (4- methoxyphenyl)- 3- methyl- 4- (thiophen- 2- yl)- 4,5- dihydro- 1H- pyrazolo[3,4- b]pyridin- 6- ol
Smiles: COc1ccc(cc1)n1nc(c2c1N=C(O)CC2c1cccs1)C

STK630880
Synonyms: N- (2,4- dichlorobenzyl)- 2- (7H- purin- 6- ylsulfanyl)propanamide
Smiles: O=C(C(Sc1ncnc2c1[nH]cn2)C)NCc1ccc(cc1Cl)Cl

STK630881
Synonyms: 1- (3,4- dimethoxyphenyl)- 6,7- dimethoxy- N- methyl- 3,4- dihydroisoquinoline- 2(1H)- carbothioamide
Smiles: CNC(=S)N1CCc2c(C1c1ccc(c(c1)OC)OC)cc(c(c2)OC)OC

STK630882
Synonyms: 2,3- dimethyl- 6- [2- (morpholin- 4- yl)ethyl]- 6H- indolo[2,3- b]quinoxaline
Smiles: Cc1cc2nc3c(nc2cc1C)n(c1c3cccc1)CCN1CCOCC1

STK630883
Synonyms: 1- (3,5- dimethylphenyl)tetrahydro- 1H- thieno[3,4- d]imidazole- 2(3H)- thione5,5- dioxide
Smiles: S=C1NC2C(N1c1cc(C)cc(c1)C)CS(=O)(=O)C2

STK630884
Synonyms: N- benzyl- 4- (4,4- dimethyl- 1,1- dioxido- 3- oxo- 1,2- thiazolidin- 2- yl)- N- phenylbenzenesulfonamide
Smiles: O=C1N(c2ccc(cc2)S(=O)(=O)N(c2ccccc2)Cc2ccccc2)S(=O)(=O)CC1(C)C

STK630885
Synonyms: 7- methoxy- N- (2- oxo- 2H- chromen- 6- yl)- 1- benzofuran- 2- carboxamide
Smiles: COc1cccc2c1oc(c2)C(=O)Nc1ccc2c(c1)ccc(=O)o2

STK630888
Synonyms: 4,5- dichloro- 1- [2- (4- methoxyphenoxy)ethyl]- 1H- imidazole
Smiles: COc1ccc(cc1)OCCn1cnc(c1Cl)Cl

STK630891
Synonyms: ethyl3- (2,3- dihydro- 1,4- benzodioxin- 6- yl)- 6- ethyl- 7- {[(2- methoxyphenyl)carbonyl]oxy}- 4- oxo- 4H- chromene- 2- carboxylate
Smiles: CCOC(=O)c1oc2cc(OC(=O)c3ccccc3OC)c(cc2c(=O)c1c1ccc2c(c1)OCCO2)CC

STK857172
Synonyms: (2Z)- 6- [2- (4- methoxyphenyl)- 2- oxoethoxy]- 2- (thiophen- 2- ylmethylidene)- 1- benzofuran- 3(2H)- one
Smiles: COc1ccc(cc1)C(=O)COc1ccc2c(c1)O/C(=C\c1cccs1)/C2=O

STK630892
Synonyms: 2- (3,4- dimethoxybenzyl)- 8,9- dimethyl- 7- (pyridin- 2- yl)- 7H- pyrrolo[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: COc1cc(ccc1OC)Cc1nn2c(n1)c1c(nc2)n(c(c1C)C)c1ccccn1

STK630893
Synonyms: N- (4H- 1,2,4- triazol- 4- yl)- 2- (2,3,5- trimethyl- 7- oxo- 7H- furo[3,2- g]chromen- 6- yl)acetamide
Smiles: O=C(Cc1c(=O)oc2c(c1C)cc1c(c2)oc(c1C)C)Nn1cnnc1

STK630897
Synonyms: N- [(2Z)- 3- (3- acetylphenyl)- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]- 1,3- benzodioxole- 5- carboxamide
Smiles: O=C(c1ccc2c(c1)OCO2)/N=C/1\SC2C(N1c1cccc(c1)C(=O)C)CS(=O)(=O)C2

STK630898
Synonyms: (2Z)- 2- (1,3- benzodioxol- 5- ylmethylidene)- 6- [(2,5- dimethylbenzyl)oxy]- 1- benzofuran- 3(2H)- one
Smiles: Cc1ccc(c(c1)COc1ccc2c(c1)O/C(=C\c1ccc3c(c1)OCO3)/C2=O)C

STK630902
Synonyms: (2E)- N- (3- acetylphenyl)- 2- [(methylsulfonyl)imino]- 2,3- dihydro- 1,3- benzothiazole- 6- carboxamide
Smiles: O=C(c1ccc2c(c1)s/c(=N/S(=O)(=O)C)/[nH]2)Nc1cccc(c1)C(=O)C

STK630903
Synonyms: N- [2- (2,3- dihydro- 1H- inden- 2- ylcarbamoyl)phenyl]- N'- [3- (dimethylamino)propyl]ethanediamide
Smiles: CN(CCCNC(=O)C(=O)Nc1ccccc1C(=O)NC1Cc2c(C1)cccc2)C

STK630904
Synonyms: (2Z)- 2- [(6- chloro- 4H- 1,3- benzodioxin- 8- yl)methylidene]- 6- [(3- methylbut- 2- en- 1- yl)oxy]- 1- benzofuran- 3(2H)- one
Smiles: CC(=CCOc1ccc2c(c1)O/C(=C\c1cc(Cl)cc3c1OCOC3)/C2=O)C

STK630906
Synonyms: N- (3- chlorophenyl)- 4- [2- (2,5- dimethyl- 1H- pyrrol- 1- yl)ethyl]piperazine- 1- carboxamide
Smiles: Clc1cccc(c1)NC(=O)N1CCN(CC1)CCn1c(C)ccc1C

STK630907
Synonyms: N- [3- cyano- 1- (4- methoxyphenyl)- 4,5- dimethyl- 1H- pyrrol- 2- yl]- 2- (2- methoxyphenoxy)acetamide
Smiles: COc1ccc(cc1)n1c(C)c(c(c1NC(=O)COc1ccccc1OC)C#N)C

STK630910
Synonyms: 2- {6- [(4- chlorophenoxy)methyl][1,2,4]triazolo[3,4- b][1,3,4]thiadiazol- 3- yl}- 1H- indole
Smiles: Clc1ccc(cc1)OCc1nn2c(s1)nnc2c1cc2c([nH]1)cccc2

STK630911
Synonyms: 4- (1- methyl- 1H- benzimidazol- 2- yl)- N- phenylpiperidine- 1- carboxamide
Smiles: O=C(N1CCC(CC1)c1nc2c(n1C)cccc2)Nc1ccccc1

STK630912
Synonyms: 2- {[2- (piperidin- 1- ylsulfonyl)ethyl](pyridin- 4- ylmethyl)carbamoyl}benzoicacid
Smiles: OC(=O)c1ccccc1C(=O)N(Cc1ccncc1)CCS(=O)(=O)N1CCCCC1

STK630914
Synonyms: 2- (7,8- dihydroxy- 4- methyl- 2- oxo- 2H- chromen- 3- yl)- N- [(2E)- 4- methyl- 1,3- thiazol- 2(3H)- ylidene]acetamide
Smiles: O=C(Cc1c(=O)oc2c(c1C)ccc(c2O)O)/N=c\1/scc([nH]1)C

STK630918
Synonyms: methyl1- (3- {[4- chloro- 5- methyl- 2- (propan- 2- yl)phenoxy]methyl}- 4- methoxyphenyl)- 2,3,4,9- tetrahydro- 1H- beta- carboline- 3- carboxylate
Smiles: COC(=O)C1NC(c2ccc(c(c2)COc2cc(C)c(cc2C(C)C)Cl)OC)c2c(C1)c1ccccc1[nH]2

STK630919
Synonyms: trans- 4- ({[(4- methylphenyl)sulfonyl]amino}methyl)- N- {(2R)- 1- oxo- 1- [(2- phenylethyl)amino]propan- 2- yl}cyclohexanecarboxamide
Smiles: O=C([C@H](NC(=O)[C@@H]1CC[C@H](CC1)CNS(=O)(=O)c1ccc(cc1)C)C)NCCc1ccccc1

STK630921
Synonyms: 4- [({N- [(4- hydroxyphthalazin- 1- yl)acetyl]alanyl}amino)methyl]cyclohexanecarboxylicacid
Smiles: O=C(Cc1nnc(c2c1cccc2)O)NC(C(=O)NCC1CCC(CC1)C(=O)O)C

STK630922
Synonyms: N- (3- chloro- 4- methoxyphenyl)- 2- (3- hydroxy- 6,7- dimethyl- 1,2- dihydroquinoxalin- 2- yl)acetamide
Smiles: COc1ccc(cc1Cl)NC(=O)CC1Nc2cc(C)c(cc2N=C1O)C

STK630925
Synonyms: (4E)- 4- ({[2- (5- methoxy- 1H- indol- 3- yl)ethyl]amino}methylidene)- 2- phenylisoquinoline- 1,3(2H,4H)- dione
Smiles: COc1ccc2c(c1)c(CCN/C=C/1\c3ccccc3C(=O)N(C1=O)c1ccccc1)c[nH]2

STK630926
Synonyms: 1- (2- chloro- 7H- purin- 6- yl)- N- [2- (5- methoxy- 1H- indol- 3- yl)ethyl]piperidine- 4- carboxamide
Smiles: COc1ccc2c(c1)c(CCNC(=O)C1CCN(CC1)c1nc(Cl)nc3c1[nH]cn3)c[nH]2

STK857173
Synonyms: 3- (3,4- dihydro- 2H- 1,5- benzodioxepin- 7- yl)- 4- oxo- 6- propyl- 4H- chromen- 7- yldimethylcarbamate
Smiles: CCCc1cc2c(cc1OC(=O)N(C)C)occ(c2=O)c1ccc2c(c1)OCCCO2

STK630931
Synonyms: 2- (4- methoxyphenyl)- N- [4- (5,6,7,8- tetrahydronaphthalen- 2- yl)- 1,2,5- oxadiazol- 3- yl]acetamide
Smiles: COc1ccc(cc1)CC(=O)Nc1nonc1c1ccc2c(c1)CCCC2

STK630932
Synonyms: 5- (2- chlorophenyl)- 2- hydroxy- 1- (tetrahydrofuran- 2- ylmethyl)pyrido[2,3- d]pyrimidin- 4(1H)- one
Smiles: Clc1ccccc1c1ccnc2c1c(=O)nc(n2CC1CCCO1)O

STK630938
Synonyms: 2- (4- chlorophenyl)- 8,9- dimethyl- 7- (pyridin- 2- ylmethyl)- 7H- pyrrolo[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: Clc1ccc(cc1)c1nn2c(n1)c1c(nc2)n(c(c1C)C)Cc1ccccn1

STK857175
Synonyms: 5- chloro- 2- (ethylsulfanyl)- N- (4- fluorophenyl)pyrimidine- 4- carboxamide
Smiles: CCSc1ncc(c(n1)C(=O)Nc1ccc(cc1)F)Cl

STK630940
Synonyms: 4- [(5Z)- 5- benzylidene- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- (quinoxalin- 6- yl)butanamide
Smiles: O=C(Nc1ccc2c(c1)nccn2)CCCN1C(=S)S/C(=C\c2ccccc2)/C1=O

STK857176
Synonyms: (2Z)- 2- (2- fluorobenzylidene)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- ylmethanesulfonate
Smiles: O=C1/C(=C/c2ccccc2F)/Oc2c1ccc(c2)OS(=O)(=O)C

STK630943
Synonyms: (2E)- N- (3- methylbutyl)- 2- [(methylsulfonyl)imino]- 2,3- dihydro- 1,3- benzothiazole- 6- carboxamide
Smiles: CC(CCNC(=O)c1ccc2c(c1)s/c(=N/S(=O)(=O)C)/[nH]2)C

STK630946
Synonyms: N- [1- ethyl- 2- oxo- 3- (piperidin- 1- ylmethyl)- 2,3- dihydro- 1H- indol- 3- yl]acetamide
Smiles: CCN1c2ccccc2C(C1=O)(CN1CCCCC1)NC(=O)C

STK630951
Synonyms: 3- hydroxy- N- {(5Z)- 5- [(1- methyl- 1,2,3,4- tetrahydroquinolin- 6- yl)methylidene]- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl}benzamide
Smiles: Oc1cccc(c1)C(=O)NN1C(=S)S/C(=C\c2ccc3c(c2)CCCN3C)/C1=O

STK630955
Synonyms: (2E)- N- (2- methylpropyl)- 2- [(methylsulfonyl)imino]- 2,3- dihydro- 1,3- benzothiazole- 6- carboxamide
Smiles: CC(CNC(=O)c1ccc2c(c1)s/c(=N/S(=O)(=O)C)/[nH]2)C

STK630957
Synonyms: 2- [(5- hydroxy- 4- oxo- 2- phenyl- 4H- chromen- 7- yl)oxy]- N- (3- methoxybenzyl)acetamide
Smiles: COc1cccc(c1)CNC(=O)COc1cc(O)c2c(c1)oc(cc2=O)c1ccccc1

STK630959
Synonyms: N- (4- hydroxy- 7- methyl- 2- sulfanylbenzo[g]pteridin- 8- yl)acetamide
Smiles: CC(=O)Nc1cc2nc3nc(S)nc(c3nc2cc1C)O

STK630962
Synonyms: N- (9,10- dioxo- 9,10- dihydroanthracen- 1- yl)- N~2~- (2- methylpropyl)glycinamide
Smiles: CC(CNCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)C

STK630965
Synonyms: [1- (3,4- diethoxybenzyl)- 6,7- diethoxy- 3,4- dihydroisoquinolin- 2(1H)- yl](2- methoxyphenyl)methanone
Smiles: CCOc1cc(ccc1OCC)CC1c2cc(OCC)c(cc2CCN1C(=O)c1ccccc1OC)OCC

STK630968
Synonyms: 5- {[(E)- (3,3- dimethyl- 1- octadecyl- 3H- indolium- 2- yl)methylidene]amino}quinolin- 6- olate
Smiles: CCCCCCCCCCCCCCCCCC[N+]1=C(/C=N/c2c([O-])ccc3c2cccn3)C(c2c1cccc2)(C)C

STK630969
Synonyms: 7- {2- [4- (4- fluorophenyl)piperazin- 1- yl]- 2- oxoethoxy}- 3- (4- methoxyphenyl)- 4H- chromen- 4- one
Smiles: COc1ccc(cc1)c1coc2c(c1=O)ccc(c2)OCC(=O)N1CCN(CC1)c1ccc(cc1)F

STK630972
Synonyms: 2- ({(2E)- 2- [(5- methoxy- 1- methyl- 1H- indol- 3- yl)methylidene]- 7- methyl- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl}oxy)acetamide
Smiles: COc1ccc2c(c1)c(/C=C\1/Oc3c(C1=O)ccc(c3C)OCC(=O)N)cn2C

STK630973
Synonyms: N- [2- (5- chloro- 1H- indol- 3- yl)ethyl]acetamide
Smiles: CC(=O)NCCc1c[nH]c2c1cc(Cl)cc2

STK630974
Synonyms: (4- {(E)- [1- (4- fluorophenyl)- 4- hydroxy- 2,6- dioxo- 1,6- dihydropyrimidin- 5(2H)- ylidene]methyl}- 2- methoxyphenoxy)aceticacid
Smiles: COc1cc(ccc1OCC(=O)O)/C=C/1\C(=NC(=O)N(C1=O)c1ccc(cc1)F)O

STK630975
Synonyms: 3- [3- (2- chlorophenyl)- 1,2,4- oxadiazol- 5- yl]- N- (quinolin- 5- yl)propanamide
Smiles: O=C(Nc1cccc2c1cccn2)CCc1onc(n1)c1ccccc1Cl

STK857178
Synonyms: (2Z)- 2- (2- bromobenzylidene)- 6- (2- oxopropoxy)- 1- benzofuran- 3(2H)- one
Smiles: CC(=O)COc1ccc2c(c1)O/C(=C\c1ccccc1Br)/C2=O

STK630976
Synonyms: 6- (3- chlorobenzyl)- 2,5- dimethyl- 3- phenylpyrazolo[1,5- a]pyrimidin- 7- ol
Smiles: Clc1cccc(c1)Cc1c(C)nc2n(c1O)nc(c2c1ccccc1)C

STK630983
Synonyms: N,N- dimethyl- 2- {[5- (pyridin- 3- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: O=C(N(C)C)CSc1nnc([nH]1)c1cccnc1

STK857181
Synonyms: N- (4- {[1- (4- chlorophenyl)- 1H- tetrazol- 5- yl]methoxy}phenyl)- N- methylacetamide
Smiles: Clc1ccc(cc1)n1nnnc1COc1ccc(cc1)N(C(=O)C)C

STK630987
Synonyms: (2Z)- 2- (4- methoxybenzylidene)- 8- (tetrahydrofuran- 2- ylmethyl)- 8,9- dihydro- 7H- furo[2,3- f][1,3]benzoxazin- 3(2H)- one
Smiles: COc1ccc(cc1)/C=C/1\Oc2c(C1=O)ccc1c2CN(CO1)CC1CCCO1

STK630988
Synonyms: 5- (4- fluorophenyl)- 2- hydroxy- 1- (2- methoxyethyl)pyrido[2,3- d]pyrimidin- 4(1H)- one
Smiles: COCCn1c(O)nc(=O)c2c1nccc2c1ccc(cc1)F

STK630990
Synonyms: N- [(2S)- 1- oxo- 1- (pyridin- 4- ylamino)propan- 2- yl]- 1- (phenylsulfonyl)piperidine- 3- carboxamide
Smiles: C[C@@H](C(=O)Nc1ccncc1)NC(=O)C1CCCN(C1)S(=O)(=O)c1ccccc1

STK630992
Synonyms: N- (5- methyl- 4,5,6,7- tetrahydro- 2,1- benzoxazol- 3- yl)- 2- phenoxyacetamide
Smiles: CC1CCc2c(C1)c(on2)NC(=O)COc1ccccc1

STK630994
Synonyms: ethyl[(2Z)- 4- (4- fluorophenyl)- 2- {[(4- methoxyphenyl)carbonyl]imino}- 2,3- dihydro- 1,3- thiazol- 5- yl]carbamate
Smiles: CCOC(=O)Nc1s/c(=N\C(=O)c2ccc(cc2)OC)/[nH]c1c1ccc(cc1)F

STK630996
Synonyms: 4- (4,4- dimethyl- 1,1- dioxido- 3- oxo- 1,2- thiazolidin- 2- yl)- N- (3- fluorophenyl)benzenesulfonamide
Smiles: Fc1cccc(c1)NS(=O)(=O)c1ccc(cc1)N1C(=O)C(CS1(=O)=O)(C)C

STK630997
Synonyms: (2- {2- [(2,4- dimethoxyphenyl)amino]- 2- oxoethoxy}phenyl)phosphonicacid
Smiles: COc1cc(OC)ccc1NC(=O)COc1ccccc1P(=O)(O)O

STK630998
Synonyms: 3- {4- [4- (4- methoxyphenoxy)butyl]piperazin- 1- yl}- 1,2- benzothiazole
Smiles: COc1ccc(cc1)OCCCCN1CCN(CC1)c1nsc2c1cccc2

STK630999
Synonyms: 1- (biphenyl- 4- ylcarbonyl)- N- (pyridin- 2- yl)piperidine- 4- carboxamide
Smiles: O=C(C1CCN(CC1)C(=O)c1ccc(cc1)c1ccccc1)Nc1ccccn1

STK631000
Synonyms: N- [2- (dimethylamino)ethyl]- Nalpha- {[4- (1H- indol- 3- ylcarbonyl)piperazin- 1- yl]carbonyl}- L- phenylalaninamide
Smiles: CN(CCNC(=O)[C@@H](NC(=O)N1CCN(CC1)C(=O)c1c[nH]c2c1cccc2)Cc1ccccc1)C

STK631003
Synonyms: 2,4- dichloro- N- [2- (piperidin- 1- ylsulfonyl)ethyl]- N- (pyridin- 4- ylmethyl)benzamide
Smiles: Clc1ccc(c(c1)Cl)C(=O)N(Cc1ccncc1)CCS(=O)(=O)N1CCCCC1

STK631005
Synonyms: 2- phenyl- 5- [(pyridin- 2- ylsulfanyl)methyl][1,2,4]triazolo[1,5- a]pyrimidin- 7- ol
Smiles: Oc1cc(CSc2ccccn2)nc2n1nc(n2)c1ccccc1

STK857185
Synonyms: 3- (4- methoxyphenoxy)- 4- oxo- 4H- chromen- 7- yl4- methoxybenzoate
Smiles: COc1ccc(cc1)Oc1coc2c(c1=O)ccc(c2)OC(=O)c1ccc(cc1)OC

STK631011
Synonyms: 4- [(3- {(5E)- 2,4- dioxo- 5- [(2E)- 3- phenylprop- 2- en- 1- ylidene]- 1,3- thiazolidin- 3- yl}propanoyl)amino]- 2- hydroxybenzoicacid
Smiles: O=C(Nc1ccc(c(c1)O)C(=O)O)CCN1C(=O)S/C(=C/C=C/c2ccccc2)/C1=O

STK631014
Synonyms: [3- (2,4- dichlorobenzyl)- 1,7- dimethyl- 2,4- dioxo- 1,2,3,4- tetrahydro- 8H- imidazo[2,1- f]purin- 8- yl]aceticacid
Smiles: OC(=O)Cn1c(C)cn2c1nc1c2c(=O)n(c(=O)n1C)Cc1ccc(cc1Cl)Cl

STK631018
Synonyms: 2- (propan- 2- yl)- 3- (pyridin- 4- ylmethyl)- 3,4- dihydro- 2H- 1,2- benzothiazin- 4- ol1,1- dioxide
Smiles: OC1C(Cc2ccncc2)N(C(C)C)S(=O)(=O)c2c1cccc2

STK631021
Synonyms: 2- [4- imino- 5,6- bis(4- methoxyphenyl)furo[2,3- d]pyrimidin- 3(4H)- yl]- N,N- dimethylethanamine
Smiles: COc1ccc(cc1)c1c(oc2c1c(=N)n(cn2)CCN(C)C)c1ccc(cc1)OC

STK631022
Synonyms: 2- imino- N- [(E)- 1H- indol- 3- ylmethylidene]tetrahydrothieno[3,4- d][1,3]thiazol- 3(2H)- amine5,5- dioxide
Smiles: N=C1SC2C(N1/N=C/c1c[nH]c3c1cccc3)CS(=O)(=O)C2

STK631032
Synonyms: 1- (pyrimidin- 2- yl)- N- (4- sulfamoylbenzyl)piperidine- 3- carboxamide
Smiles: O=C(C1CCCN(C1)c1ncccn1)NCc1ccc(cc1)S(=O)(=O)N

STK631035
Synonyms: 7- methyl- 1- (morpholin- 4- yl)- 3- [(2- oxo- 2- phenylethyl)sulfanyl]- 5,6,7,8- tetrahydro- 2,7- naphthyridine- 4- carbonitrile
Smiles: N#Cc1c(SCC(=O)c2ccccc2)nc(c2c1CCN(C2)C)N1CCOCC1

STK857187
Synonyms: N- {2- [5- (2- chlorophenyl)- 1- (methylsulfonyl)- 4,5- dihydro- 1H- pyrazol- 3- yl]phenyl}methanesulfonamide
Smiles: Clc1ccccc1C1CC(=NN1S(=O)(=O)C)c1ccccc1NS(=O)(=O)C

STK631037
Synonyms: 1- {[3- amino- 6- methyl- 4- (trifluoromethyl)thieno[2,3- b]pyridin- 2- yl]carbonyl}- L- proline
Smiles: OC(=O)[C@@H]1CCCN1C(=O)c1sc2c(c1N)c(cc(n2)C)C(F)(F)F

STK631040
Synonyms: 3- [6- (4- benzylpiperidin- 1- yl)- 6- oxohexyl]- 2- hydroxyquinazolin- 4(3H)- one
Smiles: O=C(N1CCC(CC1)Cc1ccccc1)CCCCCn1c(O)nc2c(c1=O)cccc2

STK631041
Synonyms: (2Z)- 8- (furan- 2- ylmethyl)- 2- (pyridin- 3- ylmethylidene)- 8,9- dihydro- 7H- furo[2,3- f][1,3]benzoxazin- 3(2H)- one
Smiles: O=C1/C(=C/c2cccnc2)/Oc2c1ccc1c2CN(CO1)Cc1ccco1

STK631043
Synonyms: 3- (4- fluorophenyl)- 5- methyl- 7- (morpholin- 4- yl)- 2- (trifluoromethyl)pyrazolo[1,5- a]pyrimidine
Smiles: Fc1ccc(cc1)c1c2nc(C)cc(n2nc1C(F)(F)F)N1CCOCC1

STK631045
Synonyms: 3- (3,4- dihydro- 2H- 1,5- benzodioxepin- 7- yl)- 6- ethyl- 2- methyl- 4- oxo- 4H- chromen- 7- yl3- methoxybenzoate
Smiles: CCc1cc2c(cc1OC(=O)c1cccc(c1)OC)oc(c(c2=O)c1ccc2c(c1)OCCCO2)C