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 1240 1241 1242 1243 1244 1245 1246 1247 1248 1249 Next

STK752481
Synonyms: N- (3- methoxyphenyl)- 6- nitro- 1,2- benzothiazol- 3- amine1,1- dioxide
Smiles: COc1cccc(c1)NC1=NS(=O)(=O)c2c1ccc(c2)[N+](=O)[O-]

STK752491
Synonyms: 6- chloro- N- (4- chlorophenyl)- N'- [2- (morpholin- 4- yl)ethyl]- 1,3,5- triazine- 2,4- diamine
Smiles: Clc1ccc(cc1)Nc1nc(NCCN2CCOCC2)nc(n1)Cl

STK752495
Synonyms: N- {2- [(2E)- 2- (2- bromobenzylidene)hydrazinyl]- 2- oxo- 1- (4- oxo- 3,4- dihydrophthalazin- 1- yl)ethyl}benzamide
Smiles: O=C(c1ccccc1)NC(c1n[nH]c(=O)c2c1cccc2)C(=O)N/N=C/c1ccccc1Br

STK752498
Synonyms: methyl3- (benzyloxy)- 2- (2,4- dichlorophenyl)- 4- oxoimidazolidine- 1- carboxylate
Smiles: COC(=O)N1CC(=O)N(C1c1ccc(cc1Cl)Cl)OCc1ccccc1

STK671685
Synonyms: 3,3'- [(2- phenyl- 1,3- oxazole- 4,5- diyl)bis(methanediylsulfanediyl)]bis(6- methyl- 1,2,4- triazin- 5(4H)- one)
Smiles: Cc1nnc([nH]c1=O)SCc1oc(nc1CSc1nnc(c(=O)[nH]1)C)c1ccccc1

STK752499
Synonyms: 6- chloro- N- propyl- N'- (pyridin- 3- ylmethyl)- 1,3,5- triazine- 2,4- diamine
Smiles: CCCNc1nc(NCc2cccnc2)nc(n1)Cl

STK752537
Synonyms: N'- [(E)- (2,4- dihydroxyphenyl)methylidene]- 1,5- diphenyl- 1H- 1,2,4- triazole- 3- carbohydrazide
Smiles: Oc1ccc(c(c1)O)/C=N/NC(=O)c1nc(n(n1)c1ccccc1)c1ccccc1

STK752568
Synonyms: 1,5- diphenyl- N'- [(E)- (2,3,4- trihydroxyphenyl)methylidene]- 1H- 1,2,4- triazole- 3- carbohydrazide
Smiles: O=C(c1nc(n(n1)c1ccccc1)c1ccccc1)N/N=C/c1ccc(c(c1O)O)O

STK752572
Synonyms: N'- [(E)- (4- hydroxyphenyl)methylidene]- 1,5- diphenyl- 1H- 1,2,4- triazole- 3- carbohydrazide
Smiles: Oc1ccc(cc1)/C=N/NC(=O)c1nc(n(n1)c1ccccc1)c1ccccc1

STK671740
Synonyms: 4,4'- [(2- methoxy- 5- nitrophenyl)methanediyl]bis(1,5- dimethyl- 2- phenyl- 1,2- dihydro- 3H- pyrazol- 3- one)
Smiles: COc1ccc(cc1C(c1c(C)n(n(c1=O)c1ccccc1)C)c1c(C)n(n(c1=O)c1ccccc1)C)[N+](=O)[O-]

STK671761
Synonyms: 2- (2- bromo- 4- methoxyphenoxy)- N'- [(E)- (2,5- dibromo- 3,4- dihydroxyphenyl)methylidene]acetohydrazide
Smiles: COc1ccc(c(c1)Br)OCC(=O)N/N=C/c1cc(Br)c(c(c1Br)O)O

STK752626
Synonyms: 2- (2- bromo- 4- methoxyphenoxy)- N'- [(E)- (2- hydroxy- 4- methoxyphenyl)methylidene]acetohydrazide
Smiles: COc1ccc(c(c1)Br)OCC(=O)N/N=C/c1ccc(cc1O)OC

STK671792
Synonyms: 2- (2- bromo- 4- methoxyphenoxy)- N'- [(E)- (2- hydroxyphenyl)methylidene]acetohydrazide
Smiles: COc1ccc(c(c1)Br)OCC(=O)N/N=C/c1ccccc1O

STK752667
Synonyms: 3- [(E)- {2- [hydroxy(phenyl)acetyl]hydrazinylidene}methyl]phenyl2- bromobenzoate
Smiles: O=C(C(c1ccccc1)O)N/N=C/c1cccc(c1)OC(=O)c1ccccc1Br

STK752677
Synonyms: 2- (4- bromonaphthalen- 1- yl)- N'- [(E)- (2- hydroxyphenyl)methylidene]acetohydrazide
Smiles: O=C(Cc1ccc(c2c1cccc2)Br)N/N=C/c1ccccc1O

STK671817
Synonyms: N- {2- [(2E)- 2- (2- hydroxy- 3,5- dinitrobenzylidene)hydrazinyl]- 2- oxoethyl}- 3,4,5- trimethoxybenzamide(non- preferredname)
Smiles: COc1cc(cc(c1OC)OC)C(=O)NCC(=O)N/N=C/c1cc(cc(c1O)[N+](=O)[O-])[N+](=O)[O-]

STK671821
Synonyms: 4- {(E)- [2- (3- {(4E)- 4- [4- (acetyloxy)- 3,5- dibromobenzylidene]- 5- oxo- 4,5- dihydro- 1,3- oxazol- 2- yl}- 5- {(4Z)- 4- [4- (acetyloxy)- 3,5- dibromobenzylidene]- 5- oxo- 4,5- dihydro- 1,3- oxazol- 2- yl}phenyl)- 5- oxo- 1,3- oxaz
Smiles: CC(=O)Oc1c(Br)cc(cc1Br)/C=C/1\N=C(OC1=O)c1cc(cc(c1)C1=N/C(=C/c2cc(Br)c(c(c2)Br)OC(=O)C)/C(=O)O1)C1=N/C(=C/c2cc(Br)c(c(c2)Br)OC(=O)C)/C(=O)O1

STK671822
Synonyms: 4- {(E)- [2- (3- {(4E)- 4- [4- (acetyloxy)- 3,5- diiodobenzylidene]- 5- oxo- 4,5- dihydro- 1,3- oxazol- 2- yl}- 5- {(4Z)- 4- [4- (acetyloxy)- 3,5- diiodobenzylidene]- 5- oxo- 4,5- dihydro- 1,3- oxazol- 2- yl}phenyl)- 5- oxo- 1,3- oxazol
Smiles: CC(=O)Oc1c(I)cc(cc1I)/C=C/1\N=C(OC1=O)c1cc(cc(c1)C1=N/C(=C/c2cc(I)c(c(c2)I)OC(=O)C)/C(=O)O1)C1=N/C(=C/c2cc(I)c(c(c2)I)OC(=O)C)/C(=O)O1

STK752711
Synonyms: 1- methyl- 3- [(1E)- 2- nitroprop- 1- en- 1- yl]- 1H- indole
Smiles: [O-][N+](=O)/C(=C/c1cn(c2c1cccc2)C)/C

STK671871
Synonyms: 4- [(2Z)- 2- (2,4- dichlorobenzylidene)hydrazinyl]- N- methyl- 6- (morpholin- 4- yl)- 1,3,5- triazin- 2- amine
Smiles: CNc1nc(N/N=C\c2ccc(cc2Cl)Cl)nc(n1)N1CCOCC1

STK671891
Synonyms: 4- hydroxy- 3- [(E)- {[2- (2- methylphenyl)- 1,3- benzoxazol- 5- yl]imino}methyl]benzoicacid
Smiles: OC(=O)c1ccc(c(c1)/C=N/c1ccc2c(c1)nc(o2)c1ccccc1C)O

STK752814
Synonyms: 3,4- dichloro- N- [(E)- (3,4- dichlorophenyl)methylidene]aniline
Smiles: Clc1ccc(cc1Cl)/N=C/c1ccc(c(c1)Cl)Cl

STK752838
Synonyms: 4- bromo- 2- [(E)- {2- [hydroxy(phenyl)acetyl]hydrazinylidene}methyl]phenylbenzoate
Smiles: Brc1ccc(c(c1)/C=N/NC(=O)C(c1ccccc1)O)OC(=O)c1ccccc1

STK752946
Synonyms: (4Z)- 2- (2- chloro- 5- nitrophenyl)- 4- (4- fluorobenzylidene)- 1,3- oxazol- 5(4H)- one
Smiles: Fc1ccc(cc1)/C=C/1\N=C(OC1=O)c1cc(ccc1Cl)[N+](=O)[O-]

STK752971
Synonyms: 4- [(2Z)- 2- (3- methoxybenzylidene)hydrazinyl]- 6- (morpholin- 4- yl)- N- phenyl- 1,3,5- triazin- 2- amine
Smiles: COc1cccc(c1)/C=N\Nc1nc(Nc2ccccc2)nc(n1)N1CCOCC1

STK752983
Synonyms: (4Z)- 4- [4- (benzyloxy)benzylidene]- 2- (4- tert- butylphenyl)- 1,3- oxazol- 5(4H)- one
Smiles: CC(c1ccc(cc1)C1=N/C(=C\c2ccc(cc2)OCc2ccccc2)/C(=O)O1)(C)C

STK752989
Synonyms: 4- bromo- 2- [(E)- {2- [(5- bromopyridin- 3- yl)carbonyl]hydrazinylidene}methyl]phenylfuran- 2- carboxylate
Smiles: Brc1ccc(c(c1)/C=N/NC(=O)c1cncc(c1)Br)OC(=O)c1ccco1

STK753005
Synonyms: N'- [(1E)- 1- (biphenyl- 4- yl)propylidene]- 2,3- dihydro- 1,4- benzodioxine- 2- carbohydrazide
Smiles: CC/C(=N\NC(=O)C1COc2c(O1)cccc2)/c1ccc(cc1)c1ccccc1

STK672038
Synonyms: 4- chloro- 2- {(E)- [(3- chloro- 4- methoxyphenyl)imino]methyl}- 6- nitrophenol
Smiles: COc1ccc(cc1Cl)/N=C/c1cc(Cl)cc(c1O)[N+](=O)[O-]

STK753055
Synonyms: 4- chloro- N- {2- oxo- 2- [(2E)- 2- (1- phenylbutylidene)hydrazinyl]ethyl}benzamide(non- preferredname)
Smiles: CCC/C(=N\NC(=O)CNC(=O)c1ccc(cc1)Cl)/c1ccccc1

STK672119
Synonyms: 3- fluoro- N- {2- [(2E)- 2- (2- hydroxy- 5- iodobenzylidene)hydrazinyl]- 2- oxoethyl}benzamide(non- preferredname)
Smiles: O=C(CNC(=O)c1cccc(c1)F)N/N=C/c1cc(I)ccc1O

STK753097
Synonyms: 4- bromo- 2- chloro- 6- [(E)- (quinolin- 6- ylimino)methyl]phenol
Smiles: Brc1cc(/C=N/c2ccc3c(c2)cccn3)c(c(c1)Cl)O

STK753109
Synonyms: 6- methoxytetrazolo[1,5- b]pyridazine
Smiles: COc1ccc2n(n1)nnn2

STK672127
Synonyms: oxiran- 2- ylmethyl(2,3- dimethylphenyl)carbamate
Smiles: Cc1c(NC(=O)OCC2CO2)cccc1C

STK672128
Synonyms: 4,4'- sulfanediyldiphenol
Smiles: Oc1ccc(cc1)Sc1ccc(cc1)O

STK753110
Synonyms: [3- (chloromethyl)- 2,4,6- trimethylbenzylidene]propanedinitrile
Smiles: N#CC(=Cc1c(C)cc(c(c1C)CCl)C)C#N

STK672134
Synonyms: 1,3- bis(pentafluorophenyl)urea
Smiles: O=C(Nc1c(F)c(F)c(c(c1F)F)F)Nc1c(F)c(F)c(c(c1F)F)F

STK672135
Synonyms: 1- (butylsulfinyl)dodecane
Smiles: CCCCCCCCCCCCS(=O)CCCC

STK753111
Synonyms: N- {[2- (chloroacetyl)- 1,2,3,4- tetrahydroisoquinolin- 1- yl]methyl}cyclohexanecarboxamide
Smiles: ClCC(=O)N1CCc2c(C1CNC(=O)C1CCCCC1)cccc2

STK753115
Synonyms: ethyl{2- [(2- methylphenyl)carbamoyl]hydrazinyl}acetate
Smiles: CCOC(=O)CNNC(=O)Nc1ccccc1C

STK753116
Synonyms: 6- phenoxy- 2,3,4,9- tetrahydro- 1H- carbazol- 1- one
Smiles: O=C1CCCc2c1[nH]c1c2cc(cc1)Oc1ccccc1

STK672138
Synonyms: methylN- [(benzyloxy)carbonyl]leucylleucinate
Smiles: COC(=O)C(NC(=O)C(NC(=O)OCc1ccccc1)CC(C)C)CC(C)C

STK753131
Synonyms: 2- oxo- N- phenyl- 8- (prop- 2- en- 1- yl)- 2H- chromene- 3- carboxamide
Smiles: C=CCc1cccc2c1oc(=O)c(c2)C(=O)Nc1ccccc1

STK753132
Synonyms: N- (2,4- dinitrophenyl)- 2- oxo- 2H- chromene- 3- carboxamide
Smiles: O=C(c1cc2ccccc2oc1=O)Nc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-]

STK753134
Synonyms: 5- [4- (dimethylamino)- 3- nitrobenzylidene]- 2- thioxodihydropyrimidine- 4,6(1H,5H)- dione
Smiles: S=C1NC(=O)C(=Cc2ccc(c(c2)[N+](=O)[O-])N(C)C)C(=O)N1

STK672144
Synonyms: leucylalanine
Smiles: NC(C(=O)NC(C(=O)O)C)CC(C)C

STK753140
Synonyms: N- (4,5- dimethyl- 2- nitrophenyl)pentopyranosylamine
Smiles: [O-][N+](=O)c1cc(C)c(cc1NC1OCC(C(C1O)O)O)C

STK753143
Synonyms: (4E)- 2- ethyl- N- hydroxy- 3,6- dimethyltetrahydro- 4H- thiopyran- 4- imine
Smiles: CCC1SC(C)C/C(=N\O)/C1C

STK672150
Synonyms: N- [(benzyloxy)carbonyl]tryptophylleucylarginyl- N~6~- (tert- butoxycarbonyl)- N- [16,16- dimethyl- 3,6,14- trioxo- 4- (propan- 2- yl)- 2,15- dioxa- 5,13- diazaheptadecan- 7- yl]lysinamide
Smiles: COC(=O)C(C(C)C)NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(Cc1c[nH]c2c1cccc2)NC(=O)OCc1ccccc1)CC(C)C)CCCNC(=N)N)CCCCNC(=O)OC(C)(C)C)CCCCCNC(=O)OC(C)(C)C

STK753148
Synonyms: 3b,6,6a,7,9,9a,10,12a- octahydrocyclopenta[c]cyclopenta[4,5]pyrido[3,2,1- ij]quinoline
Smiles: C1=CC2C(C1)CN1c3c2cccc3C2C(C1)CC=C2

STK672156
Synonyms: 2- [(1,1- dioxido- 1,2- benzothiazol- 3- yl)amino]ethyl2,4- dimethylbenzenesulfonate
Smiles: Cc1ccc(c(c1)C)S(=O)(=O)OCCNC1=NS(=O)(=O)c2c1cccc2

STK753174
Synonyms: (2Z)- 2- [(2- hydroxyphenyl)imino]- 1,2- diphenylethanone
Smiles: Oc1ccccc1/N=C(\C(=O)c1ccccc1)/c1ccccc1

STK753179
Synonyms: (1E)- 6- cyclohexyl- N- hydroxy- 9- methyl- 2,3,4,9- tetrahydro- 1H- carbazol- 1- imine
Smiles: O/N=C/1\CCCc2c1n(C)c1c2cc(cc1)C1CCCCC1

STK753181
Synonyms: butyl4- (2- ethoxyphenyl)- 6- methyl- 2- thioxo- 1,2,3,4- tetrahydropyrimidine- 5- carboxylate
Smiles: CCCCOC(=O)C1=C(C)NC(=S)NC1c1ccccc1OCC

STK753185
Synonyms: 6- chloro- 9- ethyl- 2,3,4,9- tetrahydro- 1H- carbazol- 1- one
Smiles: CCn1c2ccc(cc2c2c1C(=O)CCC2)Cl

STK753188
Synonyms: 2- (2- methylpropoxy)phenol
Smiles: CC(COc1ccccc1O)C

STK753191
Synonyms: methyl5- methyl- 2,4- dinitrobenzoate
Smiles: COC(=O)c1cc(C)c(cc1[N+](=O)[O-])[N+](=O)[O-]

STK753195
Synonyms: N- (2,6- dimethylphenyl)- 2- [2- (2- methylpropoxy)phenoxy]acetamide
Smiles: CC(COc1ccccc1OCC(=O)Nc1c(C)cccc1C)C

STK753201
Synonyms: 1,2- dimethyl- 1H- indol- 5- ylacetate
Smiles: CC(=O)Oc1ccc2c(c1)cc(n2C)C

STK753202
Synonyms: 2- amino- 4- (pyridin- 3- yl)- 5,6,7,8,9,10- hexahydrocycloocta[b]pyridine- 3- carbonitrile
Smiles: N#Cc1c(N)nc2c(c1c1cccnc1)CCCCCC2

STK753212
Synonyms: N- (3- chloro- 4- methylphenyl)- 4- (3- fluoro- 4- methoxyphenyl)- 1,3- thiazol- 2- amine
Smiles: COc1ccc(cc1F)c1csc(n1)Nc1ccc(c(c1)Cl)C

STK753215
Synonyms: 4- (4- {(1E)- 1- [(2E)- (1H- indol- 3- ylmethylidene)hydrazinylidene]ethyl}- 5- methyl- 1H- 1,2,3- triazol- 1- yl)- 1,2,5- oxadiazol- 3- amine
Smiles: C/C(=N\N=C\c1c[nH]c2c1cccc2)/c1nnn(c1C)c1nonc1N

STK672174
Synonyms: 4- benzyl- 1- (4- methoxyphenyl)piperazine- 2,6- dione
Smiles: COc1ccc(cc1)N1C(=O)CN(CC1=O)Cc1ccccc1

STK672175
Synonyms: 1,2,2- trimethyl- 3- {[4- (phenylamino)phenyl]carbamoyl}cyclopentanecarboxylicacid
Smiles: O=C(C1CCC(C1(C)C)(C)C(=O)O)Nc1ccc(cc1)Nc1ccccc1

STK753220
Synonyms: 1- phenyl- 1,2- dihydro- 3H- benzo[f]chromen- 3- one
Smiles: O=C1Oc2ccc3c(c2C(C1)c1ccccc1)cccc3

STK672176
Synonyms: 2,3- diphenyl- 2H- 1,4- benzoxazin- 2- ol
Smiles: OC1(Oc2ccccc2N=C1c1ccccc1)c1ccccc1

STK672178
Synonyms: 2- (2- methoxy- 5- nitrophenyl)- 5- (naphthalen- 1- yl)- 2,3- dihydro- 1,3,4- thiadiazole
Smiles: COc1ccc(cc1C1NN=C(S1)c1cccc2c1cccc2)[N+](=O)[O-]

STK753225
Synonyms: 2- amino- 4- (pyridin- 3- yl)- 5,6,7,8- tetrahydroquinoline- 3- carbonitrile
Smiles: N#Cc1c(N)nc2c(c1c1cccnc1)CCCC2

STK753226
Synonyms: methyl2- (1H- indol- 3- yl)- 4- oxopentanoate
Smiles: COC(=O)C(c1c[nH]c2c1cccc2)CC(=O)C

STK672182
Synonyms: 2,5- dimethoxy- 4- (phenylcarbonyl)- N- (2,2,6,6- tetramethylpiperidin- 4- yl)benzamide
Smiles: COc1cc(c(cc1C(=O)NC1CC(C)(C)NC(C1)(C)C)OC)C(=O)c1ccccc1

STK753236
Synonyms: 2- {[(1- methyl- 1H- imidazol- 2- yl)sulfanyl]acetyl}- 3H- benzo[f]chromen- 3- one
Smiles: O=C(c1cc2c(oc1=O)ccc1c2cccc1)CSc1nccn1C

STK672185
Synonyms: 3- (hydroxy{2- [(trimethylsilyl)oxy]cyclohexyl}phosphoryl)propanoicacid
Smiles: OC(=O)CCP(=O)(C1CCCCC1O[Si](C)(C)C)O

STK753243
Synonyms: N- [(E)- (2- methoxyphenyl)methylidene]- 5- (quinolin- 2- yl)- 4- (trifluoromethyl)- 1,3- thiazol- 2- amine
Smiles: COc1ccccc1/C=N/c1sc(c(n1)C(F)(F)F)c1ccc2c(n1)cccc2

STK672193
Synonyms: 2- [(5- {(E)- [2- (cyanoacetyl)hydrazinylidene]methyl}furan- 2- yl)sulfanyl]- N- phenylacetamide
Smiles: N#CCC(=O)N/N=C/c1ccc(o1)SCC(=O)Nc1ccccc1

STK672195
Synonyms: 2- methoxy- 6- {(E)- [2- methyl- 2- (6- nitro- 1,1- dioxido- 1,2- benzothiazol- 3- yl)hydrazinylidene]methyl}- 4- nitrophenol
Smiles: COc1cc(cc(c1O)/C=N/N(C1=NS(=O)(=O)c2c1ccc(c2)[N+](=O)[O-])C)[N+](=O)[O-]

STK753253
Synonyms: 2- [5- (2- cyanophenyl)- 2H- tetrazol- 2- yl]- N'- [(E)- (3,5- dibromo- 2- hydroxyphenyl)methylidene]acetohydrazide
Smiles: N#Cc1ccccc1c1nnn(n1)CC(=O)N/N=C/c1cc(Br)cc(c1O)Br

STK753255
Synonyms: N- (2- ethyl- 3- methylquinolin- 4- yl)- N~2~- (2,4,4- trimethylpentan- 2- yl)glycinamide
Smiles: CCc1nc2ccccc2c(c1C)NC(=O)CNC(CC(C)(C)C)(C)C

STK672200
Synonyms: 4- [(butan- 2- ylsulfanyl)methyl]- 5- methylfuran- 2- carboxylicacid
Smiles: Cc1oc(cc1CSC(CC)C)C(=O)O

STK753262
Synonyms: N- (4- fluorophenyl)- N'- {2- [4- (naphthalen- 2- ylsulfonyl)piperazin- 1- yl]ethyl}ethanediamide
Smiles: Fc1ccc(cc1)NC(=O)C(=O)NCCN1CCN(CC1)S(=O)(=O)c1ccc2c(c1)cccc2

STK672201
Synonyms: N- (furan- 2- ylmethyl)- N'- {2- [4- (4- nitrobenzyl)piperazin- 1- yl]ethyl}ethanediamide
Smiles: O=C(C(=O)NCCN1CCN(CC1)Cc1ccc(cc1)[N+](=O)[O-])NCc1ccco1

STK753263
Synonyms: 2,2- dimethyl- 5,5- bis(4- methylbenzyl)- 1,3- dioxane- 4,6- dione
Smiles: O=C1OC(C)(C)OC(=O)C1(Cc1ccc(cc1)C)Cc1ccc(cc1)C

STK753286
Synonyms: 2,4,5- trichloro- N'- (2- methylphenyl)- N'- (phenylcarbonyl)pyridine- 3- carbohydrazide
Smiles: O=C(N(c1ccccc1C)NC(=O)c1c(Cl)ncc(c1Cl)Cl)c1ccccc1

STK672209
Synonyms: 1- (4,4- diphenyl- 1,4- dihydro- 2H- 3,1- benzoxazin- 2- yl)propan- 2- ylacetate
Smiles: CC(=O)OC(CC1Nc2ccccc2C(O1)(c1ccccc1)c1ccccc1)C

STK672210
Synonyms: 2- methyl- 4,4- diphenyl- 3,4- dihydroquinazoline
Smiles: CC1=Nc2ccccc2C(N1)(c1ccccc1)c1ccccc1

STK753292
Synonyms: methyl2,5- dimethyl- 4- (4- nitrophenyl)- 1H- pyrrole- 3- carboxylate
Smiles: COC(=O)c1c(C)[nH]c(c1c1ccc(cc1)[N+](=O)[O-])C

STK753293
Synonyms: 4- (4- ethylphenyl)- 2- phenylphthalazine- 1(2H)- thione
Smiles: CCc1ccc(cc1)c1nn(c2ccccc2)c(=S)c2c1cccc2

STK672216
Synonyms: 1- (3- {[(E)- (2- hydroxy- 3- nitrophenyl)methylidene]amino}phenyl)ethanone
Smiles: CC(=O)c1cccc(c1)/N=C/c1cccc(c1O)[N+](=O)[O-]

STK672218
Synonyms: tetraethyl1,5- bis[(phenylcarbonyl)oxy]pentane- 1,1,5,5- tetracarboxylate
Smiles: CCOC(=O)C(C(=O)OCC)(OC(=O)c1ccccc1)CCCC(C(=O)OCC)(C(=O)OCC)OC(=O)c1ccccc1

STK672222
Synonyms: 1,5- bis(methylsulfanyl)naphthalene
Smiles: CSc1cccc2c1cccc2SC

STK753301
Synonyms: 3- cyclohexyl- 6,7- dihydro- 1H- cyclopenta[d]pyrimidine- 2,4(3H,5H)- dione
Smiles: O=c1[nH]c2CCCc2c(=O)n1C1CCCCC1

STK753307
Synonyms: methyl2- methoxy- 2,3- dihydro- 1,4- benzodioxine- 2- carboxylate
Smiles: COC(=O)C1(OC)COc2c(O1)cccc2

STK753311
Synonyms: (3E)- 3- [2- (phenylcarbonyl)hydrazinylidene]- N- (prop- 2- en- 1- yl)butanamide
Smiles: C=CCNC(=O)C/C(=N/NC(=O)c1ccccc1)/C

STK753314
Synonyms: (3E)- N- (4- bromophenyl)- 3- {2- [(3- bromophenyl)carbonyl]hydrazinylidene}butanamide
Smiles: C/C(=N\NC(=O)c1cccc(c1)Br)/CC(=O)Nc1ccc(cc1)Br

STK672237
Synonyms: 5- methyl- 2,4- dinitrobenzoicacid
Smiles: [O-][N+](=O)c1cc([N+](=O)[O-])c(cc1C(=O)O)C

STK672240
Synonyms: methylN- [(2,6- difluorophenyl)carbonyl]- N- (2,6- dimethylphenyl)alaninate
Smiles: COC(=O)C(N(C(=O)c1c(F)cccc1F)c1c(C)cccc1C)C

STK672243
Synonyms: 2- amino- 2- (4- propoxyphenyl)propanoicacid
Smiles: CCCOc1ccc(cc1)C(C(=O)O)(N)C

STK753324
Synonyms: 2- phenyl- 1- (4- propoxyphenyl)ethanone
Smiles: CCCOc1ccc(cc1)C(=O)Cc1ccccc1

STK672246
Synonyms: 4- hydrazinyl- 4- oxo- N- (2,4,6- trimethylphenyl)butanamide
Smiles: NNC(=O)CCC(=O)Nc1c(C)cc(cc1C)C

STK753332
Synonyms: benzene- 1,3- diylbis(4- butylbenzoate)
Smiles: CCCCc1ccc(cc1)C(=O)Oc1cccc(c1)OC(=O)c1ccc(cc1)CCCC

STK672249
Synonyms: 5- [4- (decyloxy)benzylidene]pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: CCCCCCCCCCOc1ccc(cc1)C=C1C(=O)NC(=O)NC1=O

STK753334
Synonyms: 1- (4- {[(E)- (4- nitrophenyl)methylidene]amino}phenyl)ethanone
Smiles: CC(=O)c1ccc(cc1)/N=C/c1ccc(cc1)[N+](=O)[O-]

STK672252
Synonyms: 2- tetradecyl- 1H- benzimidazole
Smiles: CCCCCCCCCCCCCCc1[nH]c2c(n1)cccc2

STK753337
Synonyms: 5- nitro- 2- phenyl- 2H- benzotriazole
Smiles: [O-][N+](=O)c1ccc2c(c1)nn(n2)c1ccccc1

STK753346
Synonyms: N- (naphthalen- 2- yl)piperidine- 1- carboxamide
Smiles: O=C(N1CCCCC1)Nc1ccc2c(c1)cccc2

STK672259
Synonyms: dimethyl2,3,5,6- tetrabromo- 7- oxabicyclo[2.2.1]heptane- 2,3- dicarboxylate
Smiles: COC(=O)C1(Br)C2OC(C1(Br)C(=O)OC)C(C2Br)Br

STK672260
Synonyms: 2- aminophenyl4- nitrobenzenesulfonate
Smiles: Nc1ccccc1OS(=O)(=O)c1ccc(cc1)[N+](=O)[O-]

STK753349
Synonyms: N- [(E)- (4- bromophenyl)methylidene]quinolin- 3- amine
Smiles: Brc1ccc(cc1)/C=N/c1cnc2c(c1)cccc2

STK753350
Synonyms: (2Z)- 2- (3,4- dimethoxyphenyl)- 3- (morpholin- 4- yl)prop- 2- enenitrile
Smiles: N#C/C(=C\N1CCOCC1)/c1ccc(c(c1)OC)OC

STK753351
Synonyms: 7- [(2,5,5,8a- tetramethyl- 6- oxo- 1,4,4a,5,6,7,8,8a- octahydronaphthalen- 1- yl)methoxy]- 2H- chromen- 2- one
Smiles: CC1=CCC2C(C1COc1ccc3c(c1)oc(=O)cc3)(C)CCC(=O)C2(C)C

STK753357
Synonyms: 2- {[(E)- (4- chlorophenyl)methylidene]amino}- 4,5,6,7- tetrahydro- 1- benzothiophene- 3- carbonitrile
Smiles: N#Cc1c(/N=C/c2ccc(cc2)Cl)sc2c1CCCC2

STK672268
Synonyms: 2- [(E)- {[2- chloro- 5- (trifluoromethyl)phenyl]imino}methyl]phenol
Smiles: Clc1ccc(cc1/N=C/c1ccccc1O)C(F)(F)F

STK753358
Synonyms: 3- amino- 1H- 1,2,4- triazole- 5- carbohydrazide
Smiles: NNC(=O)c1[nH]nc(n1)N

STK672270
Synonyms: N- [2- methyl- 4- (morpholin- 4- yl)butan- 2- yl]prop- 2- enamide
Smiles: C=CC(=O)NC(CCN1CCOCC1)(C)C

STK672271
Synonyms: 4- (4- chlorophenyl)- 2- [3- (4- chlorophenyl)- 1- ethyl- 5,5- dimethyl- 2- oxoimidazolidin- 4- yl]- 1,2,4- oxadiazolidine- 3,5- dione
Smiles: CCN1C(=O)N(C(C1(C)C)n1oc(=O)n(c1=O)c1ccc(cc1)Cl)c1ccc(cc1)Cl

STK753361
Synonyms: 1- {[2- (4- bromophenyl)- 4- propyl- 1,3- dioxolan- 2- yl]methyl}- 1H- 1,2,4- triazole
Smiles: CCCC1COC(O1)(Cn1cncn1)c1ccc(cc1)Br

STK753363
Synonyms: (1Z)- 1- (2,4- dichlorophenyl)- 4- methyl- 2- (1H- 1,2,4- triazol- 1- yl)pent- 1- en- 3- one
Smiles: Clc1ccc(c(c1)Cl)/C=C(/C(=O)C(C)C)\n1cncn1

STK753364
Synonyms: [2- (2,4- dichlorophenyl)- 2- (1H- 1,2,4- triazol- 1- ylmethyl)- 1,3- dioxolan- 4- yl]methylmethanesulfonate
Smiles: Clc1ccc(c(c1)Cl)C1(OCC(O1)COS(=O)(=O)C)Cn1cncn1

STK753368
Synonyms: methyl[(8aS)- 2,5,5,8a- tetramethyl- 3- oxo- 3,4,4a,5,6,7,8,8a- octahydronaphthalen- 1- yl]acetate
Smiles: COC(=O)CC1=C(C)C(=O)CC2[C@]1(C)CCCC2(C)C

STK672277
Synonyms: 2- amino- 9- (2,3,5- tri- O- acetylpentofuranosyl)- 9H- purin- 6- ol
Smiles: CC(=O)OC1C(OC(=O)C)C(OC1n1cnc2c1nc(N)nc2O)COC(=O)C

STK672278
Synonyms: 2- (phenylethynyl)thiophene
Smiles: c1ccc(cc1)C#Cc1cccs1

STK753383
Synonyms: 4- (morpholin- 4- ylcarbonothioyl)phenyl4- methyl- 3,5- dinitrobenzoate
Smiles: O=C(c1cc([N+](=O)[O-])c(c(c1)[N+](=O)[O-])C)Oc1ccc(cc1)C(=S)N1CCOCC1

STK672279
Synonyms: (3Z)- 3- [(2,4- dimethylphenyl)imino]- 2- nitro- 2,3- dihydro- 1H- inden- 1- one
Smiles: [O-][N+](=O)C1C(=O)c2c(/C/1=N/c1ccc(cc1C)C)cccc2

STK753389
Synonyms: (2E)- 3- (4- methoxyphenyl)- 1- (1- methylcyclohexyl)prop- 2- en- 1- one
Smiles: COc1ccc(cc1)/C=C/C(=O)C1(C)CCCCC1

STK753391
Synonyms: N- (4- {[(3E)- 4- bromo- 5- methyl- 2- oxo- 1,2- dihydro- 3H- indol- 3- ylidene]amino}phenyl)- N- methylacetamide
Smiles: CC(=O)N(c1ccc(cc1)/N=C\1/C(=O)Nc2c1c(Br)c(cc2)C)C

STK753394
Synonyms: 3- (9H- fluoren- 2- ylamino)- 5,5- dimethylcyclohex- 2- en- 1- one
Smiles: O=C1C=C(Nc2ccc3c(c2)Cc2c3cccc2)CC(C1)(C)C

STK753395
Synonyms: 2- (4- methylphenyl)- 2,3- dihydro- 4H- 1,3- benzoxazin- 4- one
Smiles: Cc1ccc(cc1)C1NC(=O)c2c(O1)cccc2

STK753400
Synonyms: 5- amino- 3- [(Z)- 1- cyano- 2- (2- fluorophenyl)ethenyl]- 1- (2- hydroxyethyl)- 1H- pyrazole- 4- carbonitrile
Smiles: OCCn1nc(c(c1N)C#N)/C(=C/c1ccccc1F)/C#N

STK672285
Synonyms: 2- (3,3,6,6- tetramethyl- 1,8- dioxo- 2,3,4,5,6,7,8,9- octahydro- 1H- xanthen- 9- yl)benzoicacid
Smiles: O=C1CC(C)(C)CC2=C1C(C1=C(O2)CC(CC1=O)(C)C)c1ccccc1C(=O)O

STK753425
Synonyms: 1- {[4- (diethylamino)phenyl]amino}- 3- methylpyrido[1,2- a]benzimidazole- 4- carbonitrile
Smiles: CCN(c1ccc(cc1)Nc1cc(C)c(c2n1c1ccccc1n2)C#N)CC

STK753451
Synonyms: 2- {(Z)- [2- (naphthalen- 1- ylacetyl)hydrazinylidene]methyl}phenyl4- nitrobenzoate
Smiles: O=C(Cc1cccc2c1cccc2)N/N=C\c1ccccc1OC(=O)c1ccc(cc1)[N+](=O)[O-]

STK273110
Synonyms: [1- (2- methylbenzyl)- 2- oxo- 1,2- dihydro- 3H- indol- 3- ylidene]propanedinitrile
Smiles: N#CC(=C1c2ccccc2N(C1=O)Cc1ccccc1C)C#N

STK273111
Synonyms: [1- (4- methylbenzyl)- 2- oxo- 1,2- dihydro- 3H- indol- 3- ylidene]propanedinitrile
Smiles: N#CC(=C1c2ccccc2N(C1=O)Cc1ccc(cc1)C)C#N

STK273133
Synonyms: [1- (3- methylbenzyl)- 2- oxo- 1,2- dihydro- 3H- indol- 3- ylidene]propanedinitrile
Smiles: N#CC(=C1c2ccccc2N(C1=O)Cc1cccc(c1)C)C#N

STK273146
Synonyms: [2- oxo- 1- (piperidin- 1- ylmethyl)- 1,2- dihydro- 3H- indol- 3- ylidene]propanedinitrile
Smiles: N#CC(=C1C(=O)N(c2c1cccc2)CN1CCCCC1)C#N

STK870066
Synonyms: 6- methyl- N'- [(E)- (1- methyl- 1H- indol- 3- yl)methylidene]pyridine- 3- carbohydrazide
Smiles: Cc1ccc(cn1)C(=O)N/N=C/c1cn(c2c1cccc2)C

STL100507
Synonyms: 2- methyl- N'- [(E)- (1- methyl- 1H- indol- 3- yl)methylidene]furan- 3- carbohydrazide
Smiles: O=C(c1ccoc1C)N/N=C/c1cn(c2c1cccc2)C

STK138722
Synonyms: 2- phenyl- N'- [(E)- pyridin- 2- ylmethylidene]acetohydrazide
Smiles: O=C(Cc1ccccc1)N/N=C/c1ccccn1

STK135222
Synonyms: 2- phenyl- N'- [(E)- pyridin- 4- ylmethylidene]acetohydrazide
Smiles: O=C(Cc1ccccc1)N/N=C/c1ccncc1

STK071574
Synonyms: 2- phenyl- N'- [(1E)- 1- (thiophen- 2- yl)ethylidene]acetohydrazide
Smiles: O=C(Cc1ccccc1)N/N=C(/c1cccs1)\C

STK166059
Synonyms: 2- phenyl- N'- [(E)- pyridin- 3- ylmethylidene]acetohydrazide
Smiles: O=C(Cc1ccccc1)N/N=C/c1cccnc1

STK166091
Synonyms: N'- [(E)- (1- methyl- 1H- pyrrol- 2- yl)methylidene]- 2- phenylacetohydrazide
Smiles: O=C(Cc1ccccc1)N/N=C/c1cccn1C

STK215203
Synonyms: N'- [(E)- pyridin- 4- ylmethylidene]benzohydrazide
Smiles: O=C(c1ccccc1)N/N=C/c1ccncc1

STK215204
Synonyms: N'- [(E)- (5- bromofuran- 2- yl)methylidene]benzohydrazide
Smiles: Brc1ccc(o1)/C=N/NC(=O)c1ccccc1

STK000759
Synonyms: N'- [(1E)- 1- (thiophen- 2- yl)ethylidene]benzohydrazide
Smiles: O=C(c1ccccc1)N/N=C(/c1cccs1)\C

STK020400
Synonyms: N'- [(3Z)- 1- methyl- 2- oxo- 1,2- dihydro- 3H- indol- 3- ylidene]benzohydrazide
Smiles: O=C(c1ccccc1)N/N=C\1/c2ccccc2N(C1=O)C

STK394887
Synonyms: N'- [(3Z)- 1- ethyl- 2- oxo- 1,2- dihydro- 3H- indol- 3- ylidene]benzohydrazide
Smiles: CCN1C(=O)/C(=N\NC(=O)c2ccccc2)/c2c1cccc2

STK217208
Synonyms: N'- [(E)- (1- methyl- 1H- pyrrol- 2- yl)methylidene]benzohydrazide
Smiles: O=C(c1ccccc1)N/N=C/c1cccn1C

STK217209
Synonyms: N'- [(E)- (2- chloro- 6- fluorophenyl)methylidene]benzohydrazide
Smiles: O=C(c1ccccc1)N/N=C/c1c(F)cccc1Cl

STK181657
Synonyms: N'- [(E)- phenylmethylidene]pyridine- 2- carbohydrazide
Smiles: O=C(c1ccccn1)N/N=C/c1ccccc1

STK181661
Synonyms: N'- [(E)- (4- chlorophenyl)methylidene]pyridine- 2- carbohydrazide
Smiles: Clc1ccc(cc1)/C=N/NC(=O)c1ccccn1

STK181669
Synonyms: N'- [(E)- (4- methoxyphenyl)methylidene]pyridine- 2- carbohydrazide
Smiles: COc1ccc(cc1)/C=N/NC(=O)c1ccccn1

STK181670
Synonyms: N'- {(E)- [4- (dimethylamino)phenyl]methylidene}pyridine- 2- carbohydrazide
Smiles: O=C(c1ccccn1)N/N=C/c1ccc(cc1)N(C)C

STK089316
Synonyms: N'- [(E)- pyridin- 4- ylmethylidene]pyridine- 2- carbohydrazide
Smiles: O=C(c1ccccn1)N/N=C/c1ccncc1

STK181679
Synonyms: N'- [(E)- 1H- indol- 3- ylmethylidene]pyridine- 2- carbohydrazide
Smiles: O=C(c1ccccn1)N/N=C/c1c[nH]c2c1cccc2

STK394888
Synonyms: N'- [(1E)- 1- (4- ethylphenyl)ethylidene]pyridine- 2- carbohydrazide
Smiles: CCc1ccc(cc1)/C(=N/NC(=O)c1ccccn1)/C

STK007300
Synonyms: N'- [(1E)- 1- (4- fluorophenyl)ethylidene]pyridine- 2- carbohydrazide
Smiles: Fc1ccc(cc1)/C(=N/NC(=O)c1ccccn1)/C

STK037757
Synonyms: N'- [(E)- (4- fluorophenyl)methylidene]pyridine- 2- carbohydrazide
Smiles: Fc1ccc(cc1)/C=N/NC(=O)c1ccccn1

STK044267
Synonyms: N'- [(3Z)- 1- methyl- 2- oxo- 1,2- dihydro- 3H- indol- 3- ylidene]pyridine- 2- carbohydrazide
Smiles: O=C(c1ccccn1)N/N=C\1/c2ccccc2N(C1=O)C

STK150841
Synonyms: N'- {(E)- [4- (propan- 2- yl)phenyl]methylidene}pyridine- 2- carbohydrazide
Smiles: O=C(c1ccccn1)N/N=C/c1ccc(cc1)C(C)C

STK166143
Synonyms: N'- [(E)- pyridin- 4- ylmethylidene]pyridine- 3- carbohydrazide
Smiles: O=C(c1cccnc1)N/N=C/c1ccncc1

STK060661
Synonyms: N'- [(E)- 1H- indol- 3- ylmethylidene]pyridine- 3- carbohydrazide
Smiles: O=C(c1cccnc1)N/N=C/c1c[nH]c2c1cccc2

STK109652
Synonyms: N'- [(E)- (5- bromofuran- 2- yl)methylidene]pyridine- 3- carbohydrazide
Smiles: Brc1ccc(o1)/C=N/NC(=O)c1cccnc1

STK166146
Synonyms: N'- [(E)- (4- fluorophenyl)methylidene]pyridine- 3- carbohydrazide
Smiles: Fc1ccc(cc1)/C=N/NC(=O)c1cccnc1

STK031772
Synonyms: N'- [(E)- (4- methylphenyl)methylidene]pyridine- 3- carbohydrazide
Smiles: Cc1ccc(cc1)/C=N/NC(=O)c1cccnc1

STK104405
Synonyms: N'- [(3Z)- 1- methyl- 2- oxo- 1,2- dihydro- 3H- indol- 3- ylidene]pyridine- 3- carbohydrazide
Smiles: O=C(c1cccnc1)N/N=C/1\C(=O)N(c2c1cccc2)C

STK062175
Synonyms: N'- [(E)- (2,6- dichlorophenyl)methylidene]pyridine- 3- carbohydrazide
Smiles: O=C(c1cccnc1)N/N=C/c1c(Cl)cccc1Cl

STK166219
Synonyms: N'- {(E)- [4- (methylsulfanyl)phenyl]methylidene}pyridine- 3- carbohydrazide
Smiles: CSc1ccc(cc1)/C=N/NC(=O)c1cccnc1

STK056539
Synonyms: N'- [(3Z)- 1- ethyl- 2- oxo- 1,2- dihydro- 3H- indol- 3- ylidene]pyridine- 3- carbohydrazide
Smiles: CCN1c2ccccc2/C(=N/NC(=O)c2cccnc2)/C1=O

STK166222
Synonyms: N'- [(E)- (3- methylthiophen- 2- yl)methylidene]pyridine- 3- carbohydrazide
Smiles: O=C(c1cccnc1)N/N=C/c1sccc1C

STK166225
Synonyms: N'- [(E)- (1- methyl- 1H- pyrrol- 2- yl)methylidene]pyridine- 3- carbohydrazide
Smiles: O=C(c1cccnc1)N/N=C/c1cccn1C

STK166227
Synonyms: N'- [(E)- (2- chloro- 6- fluorophenyl)methylidene]pyridine- 3- carbohydrazide
Smiles: O=C(c1cccnc1)N/N=C/c1c(F)cccc1Cl

STK166231
Synonyms: N'- [(E)- (4- ethylphenyl)methylidene]pyridine- 3- carbohydrazide
Smiles: CCc1ccc(cc1)/C=N/NC(=O)c1cccnc1

STK166232
Synonyms: N'- {(E)- [4- (propan- 2- yl)phenyl]methylidene}pyridine- 3- carbohydrazide
Smiles: O=C(c1cccnc1)N/N=C/c1ccc(cc1)C(C)C

STK166233
Synonyms: N'- [(Z)- (5- methylthiophen- 2- yl)methylidene]pyridine- 3- carbohydrazide
Smiles: Cc1ccc(s1)/C=N\NC(=O)c1cccnc1

STK166259
Synonyms: N'- [(E)- (2- fluorophenyl)methylidene]pyridine- 4- carbohydrazide
Smiles: O=C(c1ccncc1)N/N=C/c1ccccc1F

STK001023
Synonyms: N'- [(E)- (4- hydroxyphenyl)methylidene]pyridine- 4- carbohydrazide
Smiles: Oc1ccc(cc1)/C=N/NC(=O)c1ccncc1

STK166265
Synonyms: N'- [(E)- (2- hydroxy- 5- methylphenyl)methylidene]pyridine- 4- carbohydrazide
Smiles: Cc1ccc(c(c1)/C=N/NC(=O)c1ccncc1)O

STK166266
Synonyms: N'- [(1E,2E)- 3- phenylprop- 2- en- 1- ylidene]pyridine- 4- carbohydrazide
Smiles: O=C(c1ccncc1)N/N=C/C=C/c1ccccc1

STK166268
Synonyms: N'- [(E)- (2- methylphenyl)methylidene]pyridine- 4- carbohydrazide
Smiles: O=C(c1ccncc1)N/N=C/c1ccccc1C

STK106708
Synonyms: N'- [(E)- pyridin- 2- ylmethylidene]pyridine- 4- carbohydrazide
Smiles: O=C(c1ccncc1)N/N=C/c1ccccn1

STK166269
Synonyms: N'- [(E)- pyridin- 4- ylmethylidene]pyridine- 4- carbohydrazide
Smiles: O=C(c1ccncc1)N/N=C/c1ccncc1

STK166270
Synonyms: N'- [(E)- (5- bromofuran- 2- yl)methylidene]pyridine- 4- carbohydrazide
Smiles: Brc1ccc(o1)/C=N/NC(=O)c1ccncc1

STK166272
Synonyms: N'- [(E)- (4- fluorophenyl)methylidene]pyridine- 4- carbohydrazide
Smiles: Fc1ccc(cc1)/C=N/NC(=O)c1ccncc1

STK063544
Synonyms: N'- [(1E)- 1- phenylpropylidene]pyridine- 4- carbohydrazide
Smiles: CC/C(=N\NC(=O)c1ccncc1)/c1ccccc1

STK166273
Synonyms: N'- [(E)- (4- methylphenyl)methylidene]pyridine- 4- carbohydrazide
Smiles: Cc1ccc(cc1)/C=N/NC(=O)c1ccncc1

STK020792
Synonyms: N'- [(1E)- 1- (thiophen- 2- yl)ethylidene]pyridine- 4- carbohydrazide
Smiles: O=C(c1ccncc1)N/N=C(/c1cccs1)\C

STK050343
Synonyms: N'- {(1E,2Z)- 2- [2- (pyridin- 4- ylcarbonyl)hydrazinylidene]ethylidene}pyridine- 4- carbohydrazide
Smiles: O=C(c1ccncc1)N/N=C\C=N\NC(=O)c1ccncc1

STK166288
Synonyms: N'- [(E)- (4- tert- butylphenyl)methylidene]pyridine- 4- carbohydrazide
Smiles: O=C(c1ccncc1)N/N=C/c1ccc(cc1)C(C)(C)C

STK166298
Synonyms: N'- [(E)- naphthalen- 2- ylmethylidene]pyridine- 4- carbohydrazide
Smiles: O=C(c1ccncc1)N/N=C/c1ccc2c(c1)cccc2

STK108485
Synonyms: N'- [(E)- pyridin- 3- ylmethylidene]pyridine- 4- carbohydrazide
Smiles: O=C(c1ccncc1)N/N=C/c1cccnc1

STK181698
Synonyms: N'- [(E)- (3,4- dichlorophenyl)methylidene]pyridine- 4- carbohydrazide
Smiles: O=C(c1ccncc1)N/N=C/c1ccc(c(c1)Cl)Cl

STK181713
Synonyms: N'- {(E)- [4- (methylsulfanyl)phenyl]methylidene}pyridine- 4- carbohydrazide
Smiles: CSc1ccc(cc1)/C=N/NC(=O)c1ccncc1

STK035041
Synonyms: N'- [(E)- (1- methyl- 1H- pyrrol- 2- yl)methylidene]pyridine- 4- carbohydrazide
Smiles: O=C(c1ccncc1)N/N=C/c1cccn1C

STK181717
Synonyms: N'- [(E)- (2- chloro- 6- fluorophenyl)methylidene]pyridine- 4- carbohydrazide
Smiles: O=C(c1ccncc1)N/N=C/c1c(F)cccc1Cl

STK181721
Synonyms: N'- [(E)- (4- ethylphenyl)methylidene]pyridine- 4- carbohydrazide
Smiles: CCc1ccc(cc1)/C=N/NC(=O)c1ccncc1

STK181722
Synonyms: N'- {(E)- [4- (propan- 2- yl)phenyl]methylidene}pyridine- 4- carbohydrazide
Smiles: CC(c1ccc(cc1)/C=N/NC(=O)c1ccncc1)C

STK150842
Synonyms: N'- [(Z)- (5- chlorothiophen- 2- yl)methylidene]pyridine- 4- carbohydrazide
Smiles: Clc1ccc(s1)/C=N\NC(=O)c1ccncc1

STK191080
Synonyms: 6- methyl- N'- [(Z)- phenylmethylidene]pyridine- 3- carbohydrazide
Smiles: Cc1ccc(cn1)C(=O)N/N=C\c1ccccc1

STK191083
Synonyms: N'- [(Z)- (4- chlorophenyl)methylidene]- 6- methylpyridine- 3- carbohydrazide
Smiles: Clc1ccc(cc1)/C=N\NC(=O)c1ccc(nc1)C

STK191095
Synonyms: N'- [(Z)- (4- methoxyphenyl)methylidene]- 6- methylpyridine- 3- carbohydrazide
Smiles: COc1ccc(cc1)/C=N\NC(=O)c1ccc(nc1)C

STK191099
Synonyms: N'- {(Z)- [4- (dimethylamino)phenyl]methylidene}- 6- methylpyridine- 3- carbohydrazide
Smiles: Cc1ccc(cn1)C(=O)N/N=C\c1ccc(cc1)N(C)C

STK191106
Synonyms: 6- methyl- N'- [(Z)- pyridin- 4- ylmethylidene]pyridine- 3- carbohydrazide
Smiles: Cc1ccc(cn1)C(=O)N/N=C\c1ccncc1

STK048739
Synonyms: N'- [(E)- 1H- indol- 3- ylmethylidene]- 6- methylpyridine- 3- carbohydrazide
Smiles: Cc1ccc(cn1)C(=O)N/N=C/c1c[nH]c2c1cccc2

STK191111
Synonyms: N'- [(Z)- (4- fluorophenyl)methylidene]- 6- methylpyridine- 3- carbohydrazide
Smiles: Fc1ccc(cc1)/C=N\NC(=O)c1ccc(nc1)C

STK191112
Synonyms: 6- methyl- N'- [(Z)- (4- methylphenyl)methylidene]pyridine- 3- carbohydrazide
Smiles: Cc1ccc(cc1)/C=N\NC(=O)c1ccc(nc1)C

STK003720
Synonyms: 6- methyl- N'- [(3E)- 2- oxo- 1,2- dihydro- 3H- indol- 3- ylidene]pyridine- 3- carbohydrazide
Smiles: Cc1ccc(cn1)C(=O)N/N=C\1/C(=O)Nc2c1cccc2

STK191195
Synonyms: 6- methyl- N'- {(Z)- [4- (methylsulfanyl)phenyl]methylidene}pyridine- 3- carbohydrazide
Smiles: CSc1ccc(cc1)/C=N\NC(=O)c1ccc(nc1)C

STK076957
Synonyms: N'- [(Z)- (2- chloro- 6- fluorophenyl)methylidene]- 6- methylpyridine- 3- carbohydrazide
Smiles: Cc1ccc(cn1)C(=O)N/N=C\c1c(F)cccc1Cl

STK191206
Synonyms: N'- [(Z)- (4- ethylphenyl)methylidene]- 6- methylpyridine- 3- carbohydrazide
Smiles: CCc1ccc(cc1)/C=N\NC(=O)c1ccc(nc1)C

STK074390
Synonyms: 2- chloro- N'- [(Z)- (4- fluorophenyl)methylidene]benzohydrazide
Smiles: Fc1ccc(cc1)/C=N\NC(=O)c1ccccc1Cl

STK217250
Synonyms: 4- chloro- N'- [(Z)- pyridin- 2- ylmethylidene]benzohydrazide
Smiles: Clc1ccc(cc1)C(=O)N/N=C\c1ccccn1

STK217251
Synonyms: 4- chloro- N'- [(Z)- pyridin- 4- ylmethylidene]benzohydrazide
Smiles: Clc1ccc(cc1)C(=O)N/N=C\c1ccncc1

STK207753
Synonyms: 4- chloro- N'- [(Z)- (1- methyl- 1H- pyrrol- 2- yl)methylidene]benzohydrazide
Smiles: Clc1ccc(cc1)C(=O)N/N=C\c1cccn1C

STK028870
Synonyms: (1,3- benzodioxol- 5- ylmethylidene)propanedinitrile
Smiles: N#CC(=Cc1ccc2c(c1)OCO2)C#N

STK394947
Synonyms: 2- (pyridin- 2- yl)- 2,3,5,6,7,8- hexahydro[1]benzothieno[2,3- d]pyrimidin- 4(1H)- one
Smiles: O=C1NC(Nc2c1c1CCCCc1s2)c1ccccn1

STK394948
Synonyms: 2- (thiophen- 2- yl)- 2,3,5,6,7,8- hexahydro[1]benzothieno[2,3- d]pyrimidin- 4(1H)- one
Smiles: O=C1NC(Nc2c1c1CCCCc1s2)c1cccs1

STK394949
Synonyms: 2- (pyridin- 3- yl)- 2,3,5,6,7,8- hexahydro[1]benzothieno[2,3- d]pyrimidin- 4(1H)- one
Smiles: O=C1NC(Nc2c1c1CCCCc1s2)c1cccnc1

STK061162
Synonyms: (thiophen- 2- ylmethylidene)propanedinitrile
Smiles: N#CC(=Cc1cccs1)C#N

STK057179
Synonyms: (2- oxo- 1,2- dihydro- 3H- indol- 3- ylidene)propanedinitrile
Smiles: N#CC(=C1C(=O)Nc2c1cccc2)C#N

STK084581
Synonyms: (1- methyl- 2- oxo- 1,2- dihydro- 3H- indol- 3- ylidene)propanedinitrile
Smiles: N#CC(=C1c2ccccc2N(C1=O)C)C#N

STK008636
Synonyms: (5- bromo- 2- oxo- 1,2- dihydro- 3H- indol- 3- ylidene)propanedinitrile
Smiles: N#CC(=C1C(=O)Nc2c1cc(Br)cc2)C#N

STK031721
Synonyms: (1- ethyl- 2- oxo- 1,2- dihydro- 3H- indol- 3- ylidene)propanedinitrile
Smiles: CCN1C(=O)C(=C(C#N)C#N)c2c1cccc2

STK080946
Synonyms: [2- oxo- 1- (prop- 2- yn- 1- yl)- 1,2- dihydro- 3H- indol- 3- ylidene]propanedinitrile
Smiles: C#CCN1C(=O)C(=C(C#N)C#N)c2c1cccc2

STK066521
Synonyms: (1- benzyl- 2- oxo- 1,2- dihydro- 3H- indol- 3- ylidene)propanedinitrile
Smiles: N#CC(=C1c2ccccc2N(C1=O)Cc1ccccc1)C#N

STK062796
Synonyms: 3- (imidazo[1,2- a]pyridin- 2- yl)aniline
Smiles: Nc1cccc(c1)c1nc2n(c1)cccc2

STK005523
Synonyms: 4- (imidazo[1,2- a]pyridin- 2- yl)aniline
Smiles: Nc1ccc(cc1)c1nc2n(c1)cccc2

STK014844
Synonyms: 4- (piperidin- 1- yl)aniline
Smiles: Nc1ccc(cc1)N1CCCCC1

STK069569
Synonyms: 4- (azepan- 1- yl)aniline
Smiles: Nc1ccc(cc1)N1CCCCCC1

STK048949
Synonyms: 2- amino- 4,5- dimethylthiophene- 3- carbonitrile
Smiles: N#Cc1c(N)sc(c1C)C

STK023618
Synonyms: 4- (4- methylpiperazin- 1- yl)aniline
Smiles: CN1CCN(CC1)c1ccc(cc1)N

STK015003
Synonyms: 3- chloro- 4- (morpholin- 4- yl)aniline
Smiles: Nc1ccc(c(c1)Cl)N1CCOCC1

STK038374
Synonyms: 4- (morpholin- 4- yl)aniline
Smiles: Nc1ccc(cc1)N1CCOCC1

STK006677
Synonyms: 5- (2,4- dichlorophenyl)- 1,3,4- thiadiazol- 2- amine
Smiles: Clc1ccc(c(c1)Cl)c1nnc(s1)N

STK041133
Synonyms: (3E,5E)- 1- methyl- 3,5- bis(pyridin- 3- ylmethylidene)piperidin- 4- one
Smiles: CN1C/C(=C\c2cccnc2)/C(=O)/C(=C/c2cccnc2)/C1

STK001853
Synonyms: 3- (piperidin- 1- ylmethyl)- 1H- indole
Smiles: C1CCN(CC1)Cc1c[nH]c2c1cccc2

STK000077
Synonyms: 3- (morpholin- 4- ylmethyl)- 1H- indole
Smiles: O1CCN(CC1)Cc1c[nH]c2c1cccc2

STK071867
Synonyms: 4- (morpholin- 4- yl)- N- [(E)- pyridin- 3- ylmethylidene]aniline
Smiles: O1CCN(CC1)c1ccc(cc1)/N=C/c1cccnc1

STK001580
Synonyms: 4- (morpholin- 4- yl)- N- [(E)- 1H- pyrrol- 2- ylmethylidene]aniline
Smiles: O1CCN(CC1)c1ccc(cc1)/N=C/c1ccc[nH]1

STK011125
Synonyms: N- [(E)- (3- methylthiophen- 2- yl)methylidene]- 4- (morpholin- 4- yl)aniline
Smiles: Cc1ccsc1/C=N/c1ccc(cc1)N1CCOCC1

STK033149
Synonyms: N- [(E)- (1- methyl- 1H- pyrrol- 2- yl)methylidene]- 4- (morpholin- 4- yl)aniline
Smiles: Cn1cccc1/C=N/c1ccc(cc1)N1CCOCC1

STK070897
Synonyms: N- [(E)- (5- methylthiophen- 2- yl)methylidene]- 4- (morpholin- 4- yl)aniline
Smiles: Cc1ccc(s1)/C=N/c1ccc(cc1)N1CCOCC1

STK079060
Synonyms: N- [(E)- (3- nitrophenyl)methylidene]- 1H- indazol- 5- amine
Smiles: [O-][N+](=O)c1cccc(c1)/C=N/c1ccc2c(c1)cn[nH]2

STK078312
Synonyms: N- [(E)- (4- nitrophenyl)methylidene]- 1H- indazol- 5- amine
Smiles: [O-][N+](=O)c1ccc(cc1)/C=N/c1ccc2c(c1)cn[nH]2

STK065359
Synonyms: 3- phenyl- 1H- pyrazole- 4- carbaldehyde
Smiles: O=Cc1c[nH]nc1c1ccccc1

STK049445
Synonyms: 4- hydroxy- 3- iodobenzaldehyde
Smiles: O=Cc1ccc(c(c1)I)O

STK035096
Synonyms: 3- bromo- 4- methoxybenzaldehyde
Smiles: O=Cc1ccc(c(c1)Br)OC

STK001700
Synonyms: 5- (dimethylamino)furan- 2- carbaldehyde
Smiles: O=Cc1ccc(o1)N(C)C

STK059383
Synonyms: 4,5- dibromofuran- 2- carbaldehyde
Smiles: O=Cc1oc(c(c1)Br)Br

STK034485
Synonyms: 1- (5- bromothiophen- 2- yl)ethanone
Smiles: CC(=O)c1ccc(s1)Br

STK014392
Synonyms: 2- bromo- 5- hydroxybenzaldehyde
Smiles: O=Cc1cc(O)ccc1Br

STK803332
Synonyms: 2- chloroquinoline- 3- carbaldehyde
Smiles: O=Cc1cc2ccccc2nc1Cl

STK070473
Synonyms: 5- (2- chlorophenyl)furan- 2- carbaldehyde
Smiles: O=Cc1ccc(o1)c1ccccc1Cl

STK025558
Synonyms: 5- bromo- 1- (prop- 2- en- 1- yl)- 1H- indole- 2,3- dione
Smiles: C=CCN1C(=O)C(=O)c2c1ccc(c2)Br

STK060664
Synonyms: 5- bromo- 1- (prop- 2- yn- 1- yl)- 1H- indole- 2,3- dione
Smiles: C#CCN1C(=O)C(=O)c2c1ccc(c2)Br

STK073582
Synonyms: 4- bromothiophene- 2- carbaldehyde
Smiles: Brc1cc(sc1)C=O

STK003590
Synonyms: 5- bromo- 1- ethyl- 1H- indole- 2,3- dione
Smiles: CCN1c2ccc(cc2C(=O)C1=O)Br

STK028578
Synonyms: 5- (4- fluorophenyl)furan- 2- carbaldehyde
Smiles: O=Cc1ccc(o1)c1ccc(cc1)F

STK050665
Synonyms: 2- (furan- 2- yl)- 2,3,5,6,7,8- hexahydro[1]benzothieno[2,3- d]pyrimidin- 4(1H)- one
Smiles: O=C1NC(Nc2c1c1CCCCc1s2)c1ccco1

STK052630
Synonyms: N'- [(3Z)- 1- ethyl- 2- oxo- 1,2- dihydro- 3H- indol- 3- ylidene]- 3- methyl- 1H- pyrazole- 5- carbohydrazide
Smiles: CCN1C(=O)/C(=N\NC(=O)c2[nH]nc(c2)C)/c2c1cccc2

STK256153
Synonyms: N'- [(E)- (4- ethylphenyl)methylidene]- 3- methyl- 1H- pyrazole- 5- carbohydrazide
Smiles: CCc1ccc(cc1)/C=N/NC(=O)c1[nH]nc(c1)C

STK049275
Synonyms: 3- methyl- N'- {(E)- [4- (propan- 2- yl)phenyl]methylidene}- 1H- pyrazole- 5- carbohydrazide
Smiles: Cc1n[nH]c(c1)C(=O)N/N=C/c1ccc(cc1)C(C)C

STK185384
Synonyms: N- (4- chlorophenyl)- 1- (methylcarbamothioyl)prolinamide
Smiles: CNC(=S)N1CCCC1C(=O)Nc1ccc(cc1)Cl

STK320567
Synonyms: 1H- pyrrole- 2- carbaldehyde
Smiles: O=Cc1ccc[nH]1

STK201884
Synonyms: [1,3]thiazolo[3,2- a]benzimidazol- 3(2H)- one
Smiles: O=C1CSc2n1c1ccccc1n2

STK074674
Synonyms: 5- (pyridin- 4- yl)- 1,3,4- oxadiazole- 2- thiol
Smiles: Sc1nnc(o1)c1ccncc1

STK090249
Synonyms: 3- (piperidin- 1- ylmethyl)- 5- (pyridin- 4- yl)- 1,3,4- oxadiazole- 2(3H)- thione
Smiles: S=c1oc(nn1CN1CCCCC1)c1ccncc1

STK053369
Synonyms: 5- (pyridin- 4- yl)- 3- [2- (pyridin- 4- yl)ethyl]- 1,3,4- oxadiazole- 2(3H)- thione
Smiles: S=c1oc(nn1CCc1ccncc1)c1ccncc1

STK044095
Synonyms: N- ethyl- 5- (pyridin- 4- yl)- 1,3,4- thiadiazol- 2- amine
Smiles: CCNc1nnc(s1)c1ccncc1

STK746462
Synonyms: 2- amino- 7,8- dihydroquinazolin- 5(6H)- one
Smiles: Nc1nc2CCCC(=O)c2cn1

STK749434
Synonyms: 2- [(pyridin- 2- ylmethyl)sulfanyl]- 1H- benzimidazole
Smiles: c1ccc(nc1)CSc1nc2c([nH]1)cccc2

STK751245
Synonyms: (4E)- 2- (4- chlorophenyl)- 5- methyl- 4- [(propylamino)methylidene]- 2,4- dihydro- 3H- pyrazol- 3- one
Smiles: CCCN/C=C/1\C(=NN(C1=O)c1ccc(cc1)Cl)C

STK752060
Synonyms: 2- (3,4- dimethylphenyl)- 5- methyl- 4- [(propylamino)methylidene]- 2,4- dihydro- 3H- pyrazol- 3- one
Smiles: CCCN/C=C/1\C(=NN(C1=O)c1ccc(c(c1)C)C)C

STK753305
Synonyms: 6- bromo- 2- methyl- 1H- benzo[de]isoquinoline- 1,3(2H)- dione
Smiles: Cn1c(=O)c2cccc3c2c(c1=O)ccc3Br

STK672242
Synonyms: 6- phenyl- 4,5- dihydropyridazin- 3(2H)- one
Smiles: O=C1CCC(=NN1)c1ccccc1

STL364120
Synonyms: N- (4- fluorophenyl)- 4- phenylphthalazin- 1- amine
Smiles: Fc1ccc(cc1)Nc1nnc(c2c1cccc2)c1ccccc1

STK672309
Synonyms: (4- fluorophenyl)(3- {[(Z)- phenylmethylidene]amino}phenyl)methanone
Smiles: Fc1ccc(cc1)C(=O)c1cccc(c1)/N=C\c1ccccc1

STK753490
Synonyms: 2,4- dichloro- N- [2- (2- chloro- 4- fluorophenyl)- 1,3- benzoxazol- 5- yl]benzamide
Smiles: Fc1ccc(c(c1)Cl)c1oc2c(n1)cc(cc2)NC(=O)c1ccc(cc1Cl)Cl

STK672362
Synonyms: 2,4- dibromo- 6- {(E)- [2- (naphthalen- 1- ylacetyl)hydrazinylidene]methyl}phenylbenzoate
Smiles: Brc1cc(/C=N/NC(=O)Cc2cccc3c2cccc3)c(c(c1)Br)OC(=O)c1ccccc1

STK753503
Synonyms: 4- bromo- 2- {(E)- [2- (naphthalen- 1- ylacetyl)hydrazinylidene]methyl}phenylbenzoate
Smiles: Brc1ccc(c(c1)/C=N/NC(=O)Cc1cccc2c1cccc2)OC(=O)c1ccccc1

STK753514
Synonyms: methyl4- ({(E)- [4- (phenylethynyl)phenyl]methylidene}amino)benzoate
Smiles: COC(=O)c1ccc(cc1)/N=C/c1ccc(cc1)C#Cc1ccccc1

STK753516
Synonyms: 2- methyl- 5- nitro- N- {(E)- [4- (phenylethynyl)phenyl]methylidene}aniline
Smiles: Cc1ccc(cc1/N=C/c1ccc(cc1)C#Cc1ccccc1)[N+](=O)[O-]

STK753517
Synonyms: 2- methyl- 4- nitro- N- {(E)- [4- (phenylethynyl)phenyl]methylidene}aniline
Smiles: Cc1cc(ccc1/N=C/c1ccc(cc1)C#Cc1ccccc1)[N+](=O)[O-]

STK753520
Synonyms: (2E)- 3- (4- fluorophenyl)- 1- (4- {[(E)- (4- fluorophenyl)methylidene]amino}phenyl)prop- 2- en- 1- one
Smiles: Fc1ccc(cc1)/C=C/C(=O)c1ccc(cc1)/N=C/c1ccc(cc1)F

STK672380
Synonyms: 4,4'- methanediylbis(2- chloro- N- {(E)- [4- (phenylethynyl)phenyl]methylidene}aniline)
Smiles: Clc1cc(ccc1/N=C/c1ccc(cc1)C#Cc1ccccc1)Cc1ccc(c(c1)Cl)/N=C/c1ccc(cc1)C#Cc1ccccc1

STK753526
Synonyms: 4- [(E)- (2- {[(furan- 2- ylcarbonyl)amino]acetyl}hydrazinylidene)methyl]phenyl4- nitrobenzoate(non- preferredname)
Smiles: O=C(CNC(=O)c1ccco1)N/N=C/c1ccc(cc1)OC(=O)c1ccc(cc1)[N+](=O)[O-]

STK672425
Synonyms: N,N'- [methanediylbis(2- methoxybenzene- 4,1- diyl)]bis(2- chloroacetamide)
Smiles: ClCC(=O)Nc1ccc(cc1OC)Cc1ccc(c(c1)OC)NC(=O)CCl

STK672439
Synonyms: N,N'- (3,3'- dimethoxybiphenyl- 4,4'- diyl)bis(2- chloroacetamide)
Smiles: ClCC(=O)Nc1ccc(cc1OC)c1ccc(c(c1)OC)NC(=O)CCl

STK672440
Synonyms: N,N'- [methanediylbis(2- chlorobenzene- 4,1- diyl)]bis(2- chloroacetamide)
Smiles: ClCC(=O)Nc1ccc(cc1Cl)Cc1ccc(c(c1)Cl)NC(=O)CCl

STK672441
Synonyms: N,N'- (3,3'- dichlorobiphenyl- 4,4'- diyl)bis(2- chloroacetamide)
Smiles: ClCC(=O)Nc1ccc(cc1Cl)c1ccc(c(c1)Cl)NC(=O)CCl

STK753636
Synonyms: 4- [(E)- (2- {[(1,3- benzodioxol- 5- ylcarbonyl)amino]acetyl}hydrazinylidene)methyl]- 2- methoxyphenyl3- methoxybenzoate(non- preferredname)
Smiles: COc1cccc(c1)C(=O)Oc1ccc(cc1OC)/C=N/NC(=O)CNC(=O)c1ccc2c(c1)OCO2

STK672464
Synonyms: 4- [(E)- (2- {[(diphenylacetyl)amino]acetyl}hydrazinylidene)methyl]- 2- methoxyphenyl3- methoxybenzoate(non- preferredname)
Smiles: COc1cccc(c1)C(=O)Oc1ccc(cc1OC)/C=N/NC(=O)CNC(=O)C(c1ccccc1)c1ccccc1

STK753639
Synonyms: N'- [(1E)- 1- (3,5- dimethylfuran- 2- yl)ethylidene]- 3- methylbenzohydrazide
Smiles: Cc1cccc(c1)C(=O)N/N=C(/c1oc(cc1C)C)\C

STK753645
Synonyms: 5- {4- [bis(2- methylpropyl)amino]- 3- nitrobenzylidene}- 2- thioxodihydropyrimidine- 4,6(1H,5H)- dione
Smiles: CC(CN(c1ccc(cc1[N+](=O)[O-])C=C1C(=O)NC(=S)NC1=O)CC(C)C)C

STK753646
Synonyms: 2- (butylsulfinyl)cyclohexylbenzoate
Smiles: CCCCS(=O)C1CCCCC1OC(=O)c1ccccc1

STK753650
Synonyms: methyl2,5- dimethyl- 4- (4- methylphenyl)- 1H- pyrrole- 3- carboxylate
Smiles: COC(=O)c1c(C)[nH]c(c1c1ccc(cc1)C)C

STK753651
Synonyms: 6- ethyl- 2,5- dimethyl- 3- phenylpyrazolo[1,5- a]pyrimidin- 7- ol
Smiles: CCc1c(C)nc2n(c1O)nc(c2c1ccccc1)C

STK753652
Synonyms: methyl4- (4- chlorophenyl)- 2,5- dimethyl- 1H- pyrrole- 3- carboxylate
Smiles: COC(=O)c1c(C)[nH]c(c1c1ccc(cc1)Cl)C

STK672473
Synonyms: ethyl4- (2- methoxyphenyl)- 2,5- dimethyl- 1H- pyrrole- 3- carboxylate
Smiles: CCOC(=O)c1c(C)[nH]c(c1c1ccccc1OC)C

STK672474
Synonyms: methyl4- (4- methoxyphenyl)- 2,5- dimethyl- 1H- pyrrole- 3- carboxylate
Smiles: COc1ccc(cc1)c1c(C)[nH]c(c1C(=O)OC)C

STK753653
Synonyms: methyl2,5- dimethyl- 4- (3- nitrophenyl)- 1H- pyrrole- 3- carboxylate
Smiles: COC(=O)c1c(C)[nH]c(c1c1cccc(c1)[N+](=O)[O-])C

STK672475
Synonyms: N- (4- bromophenyl)- 3,5- bis(methylsulfanyl)- 1,2- thiazole- 4- carboxamide
Smiles: CSc1snc(c1C(=O)Nc1ccc(cc1)Br)SC

STK753654
Synonyms: naphthalen- 2- yl[(4- methyl- 2- oxo- 2H- chromen- 7- yl)oxy]acetate
Smiles: O=C(Oc1ccc2c(c1)cccc2)COc1ccc2c(c1)oc(=O)cc2C

STK753655
Synonyms: phenyl[(4- methyl- 2- oxo- 2H- chromen- 7- yl)oxy]acetate
Smiles: O=C(Oc1ccccc1)COc1ccc2c(c1)oc(=O)cc2C

STK753663
Synonyms: 4- methyl- 2- oxo- 2H- chromen- 6- yl[(4- methyl- 2- oxo- 2H- chromen- 7- yl)oxy]acetate
Smiles: O=C(Oc1ccc2c(c1)c(C)cc(=O)o2)COc1ccc2c(c1)oc(=O)cc2C

STK753669
Synonyms: 2- [2- (3,4- dimethoxyphenyl)ethyl]- 3a,4,7,7a- tetrahydro- 1H- spiro[2- aza- 4,7- methanoisoindole- 8,1'- cyclopropane]- 1,3(2H)- dione
Smiles: COc1cc(CCN2C(=O)C3C(C2=O)C2C4(C3C=C2)CC4)ccc1OC

STK753671
Synonyms: N- (1,3- thiazol- 2- yl)- 2- (7H- [1,2,4]triazolo[4,3- b][1,2,4]triazol- 3- ylsulfanyl)acetamide
Smiles: O=C(Nc1nccs1)CSc1nnc2n1nc[nH]2

STK672483
Synonyms: N,N'- [2- chloro- 5- (trifluoromethyl)benzene- 1,3- diyl]bis{2- [(7- amino- 7H- [1,2,4]triazolo[4,3- b][1,2,4]triazol- 3- yl)sulfanyl]acetamide}
Smiles: O=C(Nc1cc(cc(c1Cl)NC(=O)CSc1nnc2n1ncn2N)C(F)(F)F)CSc1nnc2n1ncn2N

STK672486
Synonyms: (5R,6R)- 6- (4- nitro- 1H- imidazol- 1- yl)- 5- phenyl- 3- [(E)- 2- phenylethenyl]cyclohex- 2- en- 1- one
Smiles: O=C1C=C(/C=C/c2ccccc2)C[C@@H]([C@H]1n1cnc(c1)[N+](=O)[O-])c1ccccc1

STK753675
Synonyms: (5R,6R)- 6- (5- nitro- 2H- tetrazol- 2- yl)- 5- phenyl- 3- (thiophen- 2- yl)cyclohex- 2- en- 1- one
Smiles: O=C1C=C(C[C@@H]([C@H]1n1nnc(n1)[N+](=O)[O-])c1ccccc1)c1cccs1

STK753676
Synonyms: (5S,6R)- 6- (5- nitro- 2H- tetrazol- 2- yl)- 3- phenyl- 5- (thiophen- 2- yl)cyclohex- 2- en- 1- one
Smiles: O=C1C=C(C[C@@H]([C@H]1n1nnc(n1)[N+](=O)[O-])c1cccs1)c1ccccc1

STK672488
Synonyms: (5R,6R)- 6- (4- nitro- 1H- imidazol- 1- yl)- 5- phenyl- 3- (thiophen- 2- yl)cyclohex- 2- en- 1- one
Smiles: O=C1C=C(C[C@@H]([C@H]1n1cnc(c1)[N+](=O)[O-])c1ccccc1)c1cccs1

STK753689
Synonyms: 2- [(E)- (9H- carbazol- 9- ylimino)methyl]phenol
Smiles: Oc1ccccc1/C=N/n1c2ccccc2c2c1cccc2

STK753700
Synonyms: 4- methyl- 2- oxo- 2H- chromen- 7- yl(naphthalen- 2- yloxy)acetate
Smiles: O=C(Oc1ccc2c(c1)oc(=O)cc2C)COc1ccc2c(c1)cccc2

STK753704
Synonyms: 2- (diphenylamino)- 2- oxoethylN- acetylvalinate
Smiles: CC(C(C(=O)OCC(=O)N(c1ccccc1)c1ccccc1)NC(=O)C)C

STK672495
Synonyms: 2- (2,5- dioxopyrrolidin- 1- yl)- N,N- diphenylacetamide
Smiles: O=C(N(c1ccccc1)c1ccccc1)CN1C(=O)CCC1=O

STK672498
Synonyms: 2- (3- {2- [3- (4- chlorophenyl)- 5- (3,4- dimethoxyphenyl)- 4,5- dihydro- 1H- pyrazol- 1- yl]- 1,3- thiazol- 4- yl}phenyl)- 1H- isoindole- 1,3(2H)- dione
Smiles: COc1cc(ccc1OC)C1CC(=NN1c1scc(n1)c1cccc(c1)N1C(=O)c2c(C1=O)cccc2)c1ccc(cc1)Cl

STK753716
Synonyms: 5- {[(E)- (5- bromothiophen- 2- yl)methylidene]amino}- 2,3- dihydrophthalazine- 1,4- dione
Smiles: Brc1ccc(s1)/C=N/c1cccc2c1c(=O)[nH][nH]c2=O

STK672502
Synonyms: 2- {[(E)- {3,5- dibromo- 2- [(2,4- dichlorobenzyl)oxy]phenyl}methylidene]amino}- 4,5,6,7- tetrahydro- 1- benzothiophene- 3- carbonitrile
Smiles: N#Cc1c(/N=C/c2cc(Br)cc(c2OCc2ccc(cc2Cl)Cl)Br)sc2c1CCCC2

STK753727
Synonyms: 3- [(2E)- 2- (2- fluorobenzylidene)hydrazinyl]- N- [(Z)- (2- fluorophenyl)methylidene]- 4H- 1,2,4- triazol- 4- amine
Smiles: Fc1ccccc1/C=N/Nc1nncn1/N=C\c1ccccc1F

STK672504
Synonyms: 1- {2- deoxy- 3- O- [(4- methylphenyl)carbonyl]pentofuranosyl}- 5- methylpyrimidine- 2,4(1H,3H)- dione
Smiles: OCC1OC(CC1OC(=O)c1ccc(cc1)C)n1cc(C)c(=O)[nH]c1=O

STK753729
Synonyms: N- (1,3- dioxo- 1,3,3a,4,7,7a- hexahydro- 2H- 4,7- methanoisoindol- 2- yl)- 2- (naphthalen- 1- yl)acetamide
Smiles: O=C(Cc1cccc2c1cccc2)NN1C(=O)C2C(C1=O)C1CC2C=C1

STK753731
Synonyms: N,N- diethyl- 2- methyl- 5- [5- (4- methylphenyl)- 1,3,4- oxadiazol- 2- yl]benzenesulfonamide
Smiles: CCN(S(=O)(=O)c1cc(ccc1C)c1nnc(o1)c1ccc(cc1)C)CC

STK753735
Synonyms: S- {2- [(5- chloropyridin- 2- yl)amino]- 2- oxoethyl}benzenecarbothioate
Smiles: O=C(Nc1ccc(cn1)Cl)CSC(=O)c1ccccc1

STK672511
Synonyms: 1- (ethylamino)- 3- (2- methoxy- 4- methylphenoxy)propan- 2- ol
Smiles: CCNCC(COc1ccc(cc1OC)C)O

STK753751
Synonyms: methyl1- (4- nitrophenyl)- 4,5- dihydro- 1H- 1,2,3- triazole- 4- carboxylate
Smiles: COC(=O)C1N=NN(C1)c1ccc(cc1)[N+](=O)[O-]

STK753758
Synonyms: 4- ({3- [5- (4- bromophenyl)- 1,3,4- oxadiazol- 2- yl]phenyl}sulfonyl)morpholine
Smiles: Brc1ccc(cc1)c1nnc(o1)c1cccc(c1)S(=O)(=O)N1CCOCC1

STK753769
Synonyms: 2- {[(E)- 2,2'- bithiophen- 5- ylmethylidene]amino}- 6- tert- butyl- 4,5,6,7- tetrahydro- 1- benzothiophene- 3- carbonitrile
Smiles: N#Cc1c(/N=C/c2ccc(s2)c2cccs2)sc2c1CCC(C2)C(C)(C)C

STK753773
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- phenyl- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: NNC(=O)c1nnn(c1c1ccccc1)c1nonc1N

STK753778
Synonyms: (3R,4S)- 4- [(acetylcarbamoyl)amino]tetrahydrothiophen- 3- ylacetate
Smiles: CC(=O)O[C@H]1CSC[C@H]1NC(=O)NC(=O)C

STK672535
Synonyms: 2- (4- bromophenyl)- 6,7- dinitro- 1H- benzo[de]isoquinoline- 1,3(2H)- dione
Smiles: Brc1ccc(cc1)n1c(=O)c2ccc(c3c2c(c1=O)ccc3[N+](=O)[O-])[N+](=O)[O-]

STK753797
Synonyms: (4E)- 2- (4- butoxyphenyl)- 4- [4- (dimethylamino)benzylidene]- 1,3- oxazol- 5(4H)- one
Smiles: CCCCOc1ccc(cc1)C1=N/C(=C/c2ccc(cc2)N(C)C)/C(=O)O1

STK753798
Synonyms: 2- amino- 1- (4- methoxyphenyl)- 5- oxo- 4- phenyl- 1,4,5,6,7,8- hexahydroquinoline- 3- carbonitrile
Smiles: N#CC1=C(N)N(C2=C(C1c1ccccc1)C(=O)CCC2)c1ccc(cc1)OC

STK672541
Synonyms: (1Z,3E)- 3- [(4- ethoxyphenyl)imino]- 1- (4- methoxyphenyl)prop- 1- en- 1- ol
Smiles: CCOc1ccc(cc1)/N=C/C=C(/c1ccc(cc1)OC)\O

STK753822
Synonyms: N- [(11Z)- 11H- indeno[1,2- b]quinolin- 11- ylidene]- 4- methylaniline
Smiles: Cc1ccc(cc1)/N=C/1\c2cc3ccccc3nc2c2c1cccc2

STK753824
Synonyms: (1E,2E)- bis(furan- 2- ylmethylidene)hydrazine
Smiles: c1coc(c1)/C=N/N=C/c1ccco1

STK672544
Synonyms: 5- diazo- 3,6,6- trimethyl- 1- phenyl- 1,5,6,7- tetrahydro- 4H- indazol- 4- one
Smiles: [N-]=[N+]=C1C(=O)c2c(C)nn(c2CC1(C)C)c1ccccc1

STK672551
Synonyms: ethyl{4- [(4,4- dimethyl- 2,6- dioxocyclohexyl)(2- hydroxy- 4,4- dimethyl- 6- oxocyclohex- 1- en- 1- yl)methyl]- 2- methoxyphenoxy}acetate
Smiles: CCOC(=O)COc1ccc(cc1OC)C(C1=C(O)CC(CC1=O)(C)C)C1C(=O)CC(CC1=O)(C)C

STK753858
Synonyms: N'- [(1E)- 1- (biphenyl- 4- yl)propylidene]- 2- (2- nitrophenoxy)acetohydrazide
Smiles: CC/C(=N\NC(=O)COc1ccccc1[N+](=O)[O-])/c1ccc(cc1)c1ccccc1

STK672561
Synonyms: N- (3,4- dimethylphenyl)- 4- [(2E)- 2- (2- hydroxy- 5- nitrobenzylidene)hydrazinyl]- 4- oxobutanamide
Smiles: O=C(CCC(=O)Nc1ccc(c(c1)C)C)N/N=C/c1cc(ccc1O)[N+](=O)[O-]

STK753871
Synonyms: 4- [(2E)- 2- (3,4- dimethoxybenzylidene)hydrazinyl]- N- (2- iodophenyl)- 4- oxobutanamide
Smiles: COc1cc(/C=N/NC(=O)CCC(=O)Nc2ccccc2I)ccc1OC

STK672564
Synonyms: (E)- 1- (4- methylphenyl)- 2- (4- nitrophenyl)diazene
Smiles: Cc1ccc(cc1)/N=N/c1ccc(cc1)[N+](=O)[O-]

STK672565
Synonyms: (3- amino- 5- ethyl- 6- methylthieno[2,3- b]pyridin- 2- yl)(phenyl)methanone
Smiles: CCc1cc2c(nc1C)sc(c2N)C(=O)c1ccccc1

STK753888
Synonyms: 2- (4- bromophenyl)- 6- ethyl- 5- methylpyrazolo[1,5- a]pyrimidin- 7- ol
Smiles: CCc1c(C)nc2n(c1O)nc(c2)c1ccc(cc1)Br

STK753892
Synonyms: benzyl2- [(4- methylphenyl)carbamoyl]- 5- oxopyrrolidine- 1- carboxylate
Smiles: Cc1ccc(cc1)NC(=O)C1CCC(=O)N1C(=O)OCc1ccccc1

STK753894
Synonyms: 4- (4- fluorophenyl)- N- (naphthalen- 1- yl)- 1,3- thiazol- 2- amine
Smiles: Fc1ccc(cc1)c1csc(n1)Nc1cccc2c1cccc2

STK753895
Synonyms: 2,4- dinitro- N- (pyridin- 3- ylmethyl)aniline
Smiles: [O-][N+](=O)c1cc(ccc1NCc1cccnc1)[N+](=O)[O-]

STK753898
Synonyms: (5Z)- 5- [4- (hexyloxy)- 3- methoxybenzylidene]- 2- thioxo- 1,3- thiazolidin- 4- one
Smiles: CCCCCCOc1ccc(cc1OC)/C=C/1\SC(=S)NC1=O

STK753901
Synonyms: 4- (morpholin- 4- ylcarbonothioyl)phenyl4- bromobenzoate
Smiles: O=C(c1ccc(cc1)Br)Oc1ccc(cc1)C(=S)N1CCOCC1

STK753903
Synonyms: N- [(4- methoxyphenyl)(phenyl)methyl]- 6- nitro- 1,2- benzothiazol- 3- amine1,1- dioxide
Smiles: COc1ccc(cc1)C(c1ccccc1)NC1=NS(=O)(=O)c2c1ccc(c2)[N+](=O)[O-]

STK753904
Synonyms: N- [2- (tert- butylsulfanyl)ethyl]- 6- nitro- 1,2- benzothiazol- 3- amine1,1- dioxide
Smiles: [O-][N+](=O)c1ccc2c(c1)S(=O)(=O)N=C2NCCSC(C)(C)C

STK753905
Synonyms: 6- nitro- N- (pentan- 3- yl)- 1,2- benzothiazol- 3- amine1,1- dioxide
Smiles: CCC(NC1=NS(=O)(=O)c2c1ccc(c2)[N+](=O)[O-])CC

STK753906
Synonyms: N- (4- butylphenyl)- 6- nitro- 1,2- benzothiazol- 3- amine1,1- dioxide
Smiles: CCCCc1ccc(cc1)NC1=NS(=O)(=O)c2c1ccc(c2)[N+](=O)[O-]

STK753914
Synonyms: 3- iodo- 4- methyl- N- [(E)- 1H- pyrrol- 2- ylmethylidene]aniline
Smiles: Cc1ccc(cc1I)/N=C/c1ccc[nH]1

STK753917
Synonyms: 1- [2- deoxy- 3- O- (2- methylpropanoyl)pentofuranosyl]- 5- methylpyrimidine- 2,4(1H,3H)- dione
Smiles: OCC1OC(CC1OC(=O)C(C)C)n1cc(C)c(=O)[nH]c1=O

STK753918
Synonyms: 1- (3- chlorobenzyl)- 3- phenyl- 1H- pyrazol- 5- amine
Smiles: Clc1cccc(c1)Cn1nc(cc1N)c1ccccc1

STK672573
Synonyms: ethyl({1- [(E)- 2- nitroethenyl]naphthalen- 2- yl}oxy)acetate
Smiles: CCOC(=O)COc1ccc2c(c1/C=C/[N+](=O)[O-])cccc2

STK753923
Synonyms: 3- (2- iodophenyl)- 1H- 1,2,4- triazol- 5- amine
Smiles: Ic1ccccc1c1n[nH]c(n1)N

STK753924
Synonyms: 2- [(2E)- 1,3- bis(4- amino- 1,2,5- oxadiazol- 3- yl)triaz- 2- en- 1- yl]- N- (3- nitrophenyl)acetamide
Smiles: O=C(CN(c1nonc1N)/N=N/c1nonc1N)Nc1cccc(c1)[N+](=O)[O-]

STK753932
Synonyms: N- (2- methylphenyl)- 6- [(2E)- 2- (naphthalen- 1- ylmethylidene)hydrazinyl][1,2,5]oxadiazolo[3,4- b]pyrazin- 5- amine
Smiles: Cc1ccccc1Nc1nc2nonc2nc1N/N=C/c1cccc2c1cccc2

STK753936
Synonyms: Nalpha- (tert- butoxycarbonyl)- N- (2- methylphenyl)tryptophanamide
Smiles: O=C(OC(C)(C)C)NC(C(=O)Nc1ccccc1C)Cc1c[nH]c2c1cccc2

STK753940
Synonyms: 2- methoxy- 4- (morpholin- 4- ylcarbonothioyl)phenyl3,4,5- trimethoxybenzoate
Smiles: COc1cc(ccc1OC(=O)c1cc(OC)c(c(c1)OC)OC)C(=S)N1CCOCC1

STK672581
Synonyms: 2- {(E)- [2- (4- amino- 5- methyl- 4H- 1,2,4- triazol- 3- yl)hydrazinylidene]methyl}- 4,6- dinitrophenol
Smiles: [O-][N+](=O)c1cc(/C=N/Nc2nnc(n2N)C)c(c(c1)[N+](=O)[O-])O

STK672582
Synonyms: N- (4- iodophenyl)- N'- (2- {4- [(3- iodophenyl)carbonyl]piperazin- 1- yl}ethyl)ethanediamide
Smiles: Ic1ccc(cc1)NC(=O)C(=O)NCCN1CCN(CC1)C(=O)c1cccc(c1)I

STK753945
Synonyms: 4- phenyl- 3,4,5,6- tetrahydrobenzo[h]quinazolin- 2(1H)- one
Smiles: O=C1NC(c2ccccc2)C2=C(N1)c1ccccc1CC2

STK753952
Synonyms: 5- [5- (2- chloro- 5- nitrophenyl)furan- 2- yl]- 3,3- dimethyl- 3,4,5,6- tetrahydrobenzo[a]phenanthridin- 1(2H)- one
Smiles: O=C1CC(C)(C)CC2=C1c1c(NC2c2ccc(o2)c2cc(ccc2Cl)[N+](=O)[O-])ccc2c1cccc2

STK753956
Synonyms: 2- [(2E)- 1,3- bis(4- amino- 1,2,5- oxadiazol- 3- yl)triaz- 2- en- 1- yl]- N- (2,6- dimethylphenyl)acetamide
Smiles: O=C(Nc1c(C)cccc1C)CN(c1nonc1N)/N=N/c1nonc1N

STK753970
Synonyms: benzyl2- [(2,4- dimethylphenyl)carbamoyl]- 5- oxopyrrolidine- 1- carboxylate
Smiles: Cc1ccc(c(c1)C)NC(=O)C1CCC(=O)N1C(=O)OCc1ccccc1

STK672590
Synonyms:
Smiles: Cc1cccc(c1)OP(=O)(Oc1cccc(c1)C)N/N=C/c1cc2OCOc2cc1[N+](=O)[O-]

STK753977
Synonyms: 2- [1- (4- nitrophenyl)- 1H- pyrrol- 2- yl]- 4,5- diphenyl- 1H- imidazole
Smiles: [O-][N+](=O)c1ccc(cc1)n1cccc1c1nc(c([nH]1)c1ccccc1)c1ccccc1

STK753982
Synonyms: ethyl{[(5E)- 5- (4- chlorobenzylidene)- 4- oxo- 4,5- dihydro- 1,3- thiazol- 2- yl]sulfanyl}acetate
Smiles: CCOC(=O)CSC1=NC(=O)/C(=C\c2ccc(cc2)Cl)/S1

STK753985
Synonyms: 2- [(3s,5s,7s)- tricyclo[3.3.1.1~3,7~]dec- 1- ylmethyl]- 3a,4,7,7a- tetrahydro- 1H- spiro[2- aza- 4,7- methanoisoindole- 8,1'- cyclopropane]- 1,3(2H)- dione
Smiles: O=C1N(CC23C[C@@H]4C[C@H](C3)C[C@H](C2)C4)C(=O)C2C1C1C=CC2C21CC2

STK753994
Synonyms: ethyl2- ({[(1- methyl- 1H- imidazol- 2- yl)sulfanyl]acetyl}amino)- 5,6- dihydro- 4H- cyclopenta[b]thiophene- 3- carboxylate
Smiles: CCOC(=O)c1c(NC(=O)CSc2nccn2C)sc2c1CCC2

STK754000
Synonyms: N- benzyl- 2- (4- nitro- 1,3- dioxo- 1,3- dihydro- 2H- isoindol- 2- yl)acetamide
Smiles: O=C(CN1C(=O)c2c(C1=O)cccc2[N+](=O)[O-])NCc1ccccc1

STK672601
Synonyms: 1- acetyl- 2- (2,4- dichlorophenyl)- 3- [(methylsulfanyl)methoxy]imidazolidin- 4- one
Smiles: CSCON1C(=O)CN(C1c1ccc(cc1Cl)Cl)C(=O)C

STK754003
Synonyms: ethyl2- [({[2- (2,5- dioxopyrrolidin- 1- yl)propanoyl]oxy}acetyl)amino]- 4,5,6,7- tetrahydro- 1- benzothiophene- 3- carboxylate
Smiles: CCOC(=O)c1c(NC(=O)COC(=O)C(N2C(=O)CCC2=O)C)sc2c1CCCC2

STK672603
Synonyms: N- (4- {[(E)- (3- methylthiophen- 2- yl)methylidene]amino}phenyl)acetamide
Smiles: CC(=O)Nc1ccc(cc1)/N=C/c1sccc1C

STK754022
Synonyms: 2- (propan- 2- yl)- 8- (propan- 2- ylidene)- 3a,4,7,7a- tetrahydro- 1H- 4,7- methanoisoindole- 1,3(2H)- dione
Smiles: CC(N1C(=O)C2C(C1=O)C1C(=C(C)C)C2C=C1)C

STK754023
Synonyms: (6- chloro- 2- oxo- 1,3- benzoxazol- 3(2H)- yl)methylphenylcarbamate
Smiles: O=C(Nc1ccccc1)OCn1c(=O)oc2c1ccc(c2)Cl

STK754025
Synonyms: 2- (3- {2- [(2- methoxyphenyl)amino]- 1,3- thiazol- 4- yl}phenyl)- 1H- isoindole- 1,3(2H)- dione
Smiles: COc1ccccc1Nc1scc(n1)c1cccc(c1)N1C(=O)c2c(C1=O)cccc2

STK754050
Synonyms: benzyl2'- amino- 7'- methyl- 2,5'- dioxo- 1,2- dihydro- 5'H- spiro[indole- 3,4'- pyrano[4,3- b]pyran]- 3'- carboxylate
Smiles: Cc1cc2OC(=C(C3(c2c(=O)o1)C(=O)Nc1c3cccc1)C(=O)OCc1ccccc1)N

STK754064
Synonyms: 2- {[2- (3,4- dimethoxyphenyl)- 2- oxoethyl]sulfanyl}- 4- (4- fluorophenyl)- 6- phenylpyridine- 3- carbonitrile
Smiles: N#Cc1c(SCC(=O)c2ccc(c(c2)OC)OC)nc(cc1c1ccc(cc1)F)c1ccccc1

STK754067
Synonyms: 2- [(2- chlorobenzyl)sulfanyl]- 6- phenylpyridine- 3- carbonitrile
Smiles: N#Cc1ccc(nc1SCc1ccccc1Cl)c1ccccc1

STK754087
Synonyms: (2R,3R,10bS)- 3- acetyl- 2- (thiophen- 2- yl)- 2,3- dihydropyrrolo[2,1- a]isoquinoline- 1,1(10bH)- dicarbonitrile
Smiles: N#CC1(C#N)[C@@H]2c3ccccc3C=CN2[C@H]([C@@H]1c1cccs1)C(=O)C

STK672617
Synonyms: 2,6- diamino- 4- (2,4- difluorophenyl)- 4H- thiopyran- 3,5- dicarbonitrile
Smiles: N#CC1=C(N)SC(=C(C1c1ccc(cc1F)F)C#N)N

STK754091
Synonyms: (8R,8aS)- 6- amino- 8- (2,3- dichlorophenyl)- 2- ethyl- 2,3,8,8a- tetrahydroisoquinoline- 5,7,7(1H)- tricarbonitrile
Smiles: CCN1CC=C2[C@@H](C1)[C@@H](c1cccc(c1Cl)Cl)C(C(=C2C#N)N)(C#N)C#N

STK754108
Synonyms: 6- amino- 4- (furan- 3- yl)- 3- methyl- 1- phenyl- 1,4- dihydropyrano[2,3- c]pyrazole- 5- carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1cocc1)c(C)nn2c1ccccc1

STK754109
Synonyms: 5- acetyl- 2- amino- 4- (2- chloro- 5- nitrophenyl)- 6- methyl- 4H- pyran- 3- carbonitrile
Smiles: N#CC1=C(N)OC(=C(C1c1cc(ccc1Cl)[N+](=O)[O-])C(=O)C)C

STK754110
Synonyms: 2- amino- 5- oxo- 4- [4- (pyrrolidin- 1- yl)phenyl]- 5,6,7,8- tetrahydro- 4H- chromene- 3- carbonitrile
Smiles: N#CC1=C(N)OC2=C(C1c1ccc(cc1)N1CCCC1)C(=O)CCC2

STK754115
Synonyms: 2,2'- [(4- cyano- 1,2- thiazole- 3,5- diyl)disulfanediyl]bis(N- cyclopropylacetamide)
Smiles: N#Cc1c(SCC(=O)NC2CC2)snc1SCC(=O)NC1CC1

STK754116
Synonyms: 3,5- bis[(4- methoxybenzyl)sulfanyl]- 1,2- thiazole- 4- carbonitrile
Smiles: COc1ccc(cc1)CSc1snc(c1C#N)SCc1ccc(cc1)OC

STK754118
Synonyms: (1S,2S,3aR)- 2- (biphenyl- 4- yl)- 7- chloro- 1- (trifluoroacetyl)- 1,2- dihydropyrrolo[1,2- a]quinoline- 3,3(3aH)- dicarbonitrile
Smiles: N#CC1(C#N)[C@H](c2ccc(cc2)c2ccccc2)[C@H](N2[C@@H]1C=Cc1c2ccc(c1)Cl)C(=O)C(F)(F)F

STK754124
Synonyms: (1S,2R,3aR)- 2- (2- chloro- 6- fluorophenyl)- 1- [(4- fluorophenyl)carbonyl]- 1,2- dihydropyrrolo[1,2- a]quinoline- 3,3(3aH)- dicarbonitrile
Smiles: N#CC1(C#N)[C@@H]([C@H](N2[C@@H]1C=Cc1c2cccc1)C(=O)c1ccc(cc1)F)c1c(F)cccc1Cl

STK754127
Synonyms: 4- amino- 3- [(cyanomethyl)sulfanyl]thieno[3,2- d][1,2]thiazole- 5- carbonitrile
Smiles: N#CCSc1nsc2c1c(N)c(s2)C#N

STK672620
Synonyms: 2- amino- 9- ethyl- 4- sulfanyl- 3,9- diazaspiro[5.5]undeca- 1,4- diene- 1,5- dicarbonitrile
Smiles: CCN1CCC2(CC1)C(=C(N)NC(=C2C#N)S)C#N

STK672621
Synonyms: 2- amino- 9- methyl- 4- sulfanyl- 3,9- diazaspiro[5.5]undeca- 1,4- diene- 1,5- dicarbonitrile
Smiles: N#CC1=C(N)NC(=C(C21CCN(CC2)C)C#N)S

STK672622
Synonyms: 2- amino- 9- (propan- 2- yl)- 4- sulfanyl- 3,9- diazaspiro[5.5]undeca- 1,4- diene- 1,5- dicarbonitrile
Smiles: N#CC1=C(N)NC(=C(C21CCN(CC2)C(C)C)C#N)S

STK754136
Synonyms: 2,2'- [(4- cyano- 1,2- thiazole- 3,5- diyl)disulfanediyl]bis(N- tert- butylacetamide)
Smiles: N#Cc1c(SCC(=O)NC(C)(C)C)snc1SCC(=O)NC(C)(C)C

STK754139
Synonyms: 3,5- bis[(4- fluorobenzyl)sulfanyl]- 1,2- thiazole- 4- carbonitrile
Smiles: N#Cc1c(SCc2ccc(cc2)F)nsc1SCc1ccc(cc1)F

STK754145
Synonyms: 1- {4- [(6- nitro- 1,1- dioxido- 1,2- benzothiazol- 3- yl)amino]phenyl}ethanone
Smiles: CC(=O)c1ccc(cc1)NC1=NS(=O)(=O)c2c1ccc(c2)[N+](=O)[O-]

STK672627
Synonyms: N- (4- chlorophenyl)- N'- {2- [4- (4- nitrobenzyl)piperazin- 1- yl]ethyl}ethanediamide
Smiles: Clc1ccc(cc1)NC(=O)C(=O)NCCN1CCN(CC1)Cc1ccc(cc1)[N+](=O)[O-]

STK754151
Synonyms: methyl4- [2- oxo- 2- (4,5,6,7- tetrahydro- 1,3- benzothiazol- 2- ylamino)ethoxy]benzoate
Smiles: COC(=O)c1ccc(cc1)OCC(=O)Nc1nc2c(s1)CCCC2

STK754156
Synonyms: 2- [(4- methyl- 2- oxo- 2H- chromen- 7- yl)oxy]- N- (4- sulfamoylphenyl)acetamide
Smiles: O=C(Nc1ccc(cc1)S(=O)(=O)N)COc1ccc2c(c1)oc(=O)cc2C

STK754160
Synonyms: N- {4- [(5- ethyl- 1,3,4- thiadiazol- 2- yl)sulfamoyl]phenyl}- 2- phenylacetamide
Smiles: CCc1nnc(s1)NS(=O)(=O)c1ccc(cc1)NC(=O)Cc1ccccc1

STK754164
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- (2,3- dichlorophenyl)methylidene]- 5- phenyl- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: O=C(c1nnn(c1c1ccccc1)c1nonc1N)N/N=C/c1cccc(c1Cl)Cl

STK754188
Synonyms: 2- (3- bromo- 4- methoxyphenyl)- 3- [(3- methylphenyl)sulfonyl]- 1,3- thiazolidine
Smiles: COc1ccc(cc1Br)C1SCCN1S(=O)(=O)c1cccc(c1)C

STK672633
Synonyms: 4- (1- benzofuran- 2- yl)- N- (2- methoxyphenyl)- 1,3- thiazol- 2- amine
Smiles: COc1ccccc1Nc1scc(n1)c1cc2c(o1)cccc2

STK672638
Synonyms: 4- chloro- N- [5- (3- methylphenyl)- 1,3,4- oxadiazol- 2- yl]benzamide
Smiles: Clc1ccc(cc1)C(=O)Nc1nnc(o1)c1cccc(c1)C

STK754201
Synonyms: N- {4- [(1E)- 1- {2- [4- (benzylamino)- 6- (morpholin- 4- yl)- 1,3,5- triazin- 2- yl]hydrazinylidene}ethyl]phenyl}acetamide
Smiles: CC(=O)Nc1ccc(cc1)/C(=N/Nc1nc(NCc2ccccc2)nc(n1)N1CCOCC1)/C

STK754211
Synonyms: 2- [(3- fluorobenzyl)sulfanyl]- 4- (4- methoxyphenyl)- 6- phenylpyridine- 3- carbonitrile
Smiles: COc1ccc(cc1)c1cc(nc(c1C#N)SCc1cccc(c1)F)c1ccccc1

STK754213
Synonyms: 2,2'- [(4- cyano- 1,2- thiazole- 3,5- diyl)disulfanediyl]bis[N- (2,4- dimethylphenyl)acetamide]
Smiles: N#Cc1c(SCC(=O)Nc2ccc(cc2C)C)nsc1SCC(=O)Nc1ccc(cc1C)C

STK754221
Synonyms: 2- {[4- cyano- 5- (methylsulfanyl)- 1,2- thiazol- 3- yl]sulfanyl}acetamide
Smiles: CSc1snc(c1C#N)SCC(=O)N

STK754222
Synonyms: 2- ({5- [(4- chlorobenzyl)sulfanyl]- 4- cyano- 1,2- thiazol- 3- yl}sulfanyl)acetamide
Smiles: N#Cc1c(SCc2ccc(cc2)Cl)snc1SCC(=O)N

STK672649
Synonyms: 2- ({5- [(2- chlorobenzyl)sulfanyl]- 4- cyano- 1,2- thiazol- 3- yl}sulfanyl)acetamide
Smiles: N#Cc1c(snc1SCC(=O)N)SCc1ccccc1Cl

STK754225
Synonyms: 6- [(2E)- 2- (2,4- dimethoxybenzylidene)hydrazinyl]- 3- (trifluoromethyl)[1,2,4]triazolo[4,3- b]pyridazine
Smiles: COc1ccc(c(c1)OC)/C=N/Nc1ccc2n(n1)c(nn2)C(F)(F)F

STK754227
Synonyms: N- (2- methylphenyl)[1,2,5]oxadiazolo[3,4- e]tetrazolo[1,5- a]pyrazin- 5- amine
Smiles: Cc1ccccc1Nc1nc2nonc2n2c1nnn2

STK754229
Synonyms: 1,5- dimethyl- 4- {[(Z)- {3- nitro- 4- [(6- nitro- 1,3- benzothiazol- 2- yl)sulfanyl]phenyl}methylidene]amino}- 2- phenyl- 1,2- dihydro- 3H- pyrazol- 3- one
Smiles: [O-][N+](=O)c1cc(ccc1Sc1nc2c(s1)cc(cc2)[N+](=O)[O-])/C=N\c1c(C)n(n(c1=O)c1ccccc1)C

STK754233
Synonyms: (1Z,2Z)- N~1~,N~2~- bis(3,4- dimethylphenyl)- N'~1~,N'~2~- dihydroxyethanediimidamide
Smiles: O/N=C(/C(=N/O)/Nc1ccc(c(c1)C)C)\Nc1ccc(c(c1)C)C

STK754239
Synonyms: benzene- 1,3- diylbis[(4- methylphenyl)methanone]
Smiles: O=C(c1ccc(cc1)C)c1cccc(c1)C(=O)c1ccc(cc1)C

STK754242
Synonyms: 2- [(1,1- dioxido- 1,2- benzothiazol- 3- yl)sulfanyl]ethyl3- methylbenzoate
Smiles: Cc1cccc(c1)C(=O)OCCSC1=NS(=O)(=O)c2c1cccc2

STK754247
Synonyms: N- (1,3- thiazol- 2- yl)- 4- [(trifluoroacetyl)amino]benzamide
Smiles: O=C(C(F)(F)F)Nc1ccc(cc1)C(=O)Nc1nccs1

STK672650
Synonyms: N,N'- (3,3'- dimethoxybiphenyl- 4,4'- diyl)bis{2- [(6- amino- 3,5- dicyanopyridin- 2- yl)sulfanyl]acetamide}
Smiles: COc1cc(ccc1NC(=O)CSc1nc(N)c(cc1C#N)C#N)c1ccc(c(c1)OC)NC(=O)CSc1nc(N)c(cc1C#N)C#N

STK754268
Synonyms: 2- (2- hydroxyethyl)- 3a,4,7,7a- tetrahydro- 1H- spiro[2- aza- 4,7- methanoisoindole- 8,1'- cyclopropane]- 1,3(2H)- dione
Smiles: OCCN1C(=O)C2C(C1=O)C1C3(C2C=C1)CC3

STK672653
Synonyms: 2- (4- methylpent- 3- en- 1- yl)quinoline- 4- carboxylicacid
Smiles: CC(=CCCc1nc2ccccc2c(c1)C(=O)O)C

STK672654
Synonyms: 2- methyl- 3- (3- methylbut- 2- en- 1- yl)quinoline- 4- carboxylicacid
Smiles: CC(=CCc1c(C)nc2c(c1C(=O)O)cccc2)C

STK754278
Synonyms: ethyl1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- (morpholin- 4- ylmethyl)- 1H- 1,2,3- triazole- 4- carboxylate
Smiles: CCOC(=O)c1nnn(c1CN1CCOCC1)c1nonc1N

STK672660
Synonyms: ethyl1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- (azepan- 1- ylmethyl)- 1H- 1,2,3- triazole- 4- carboxylate
Smiles: CCOC(=O)c1nnn(c1CN1CCCCCC1)c1nonc1N

STK672661
Synonyms: ethyl1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- [(4- methylpiperazin- 1- yl)methyl]- 1H- 1,2,3- triazole- 4- carboxylate
Smiles: CCOC(=O)c1nnn(c1CN1CCN(CC1)C)c1nonc1N

STK672662
Synonyms: ethyl1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- (pyrrolidin- 1- ylmethyl)- 1H- 1,2,3- triazole- 4- carboxylate
Smiles: CCOC(=O)c1nnn(c1CN1CCCC1)c1nonc1N

STK754280
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 1,5,6,7- tetrahydro- 4H- benzotriazol- 4- one
Smiles: O=C1CCCc2c1nnn2c1nonc1N

STK754281
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 7,7- dimethyl- 1,5,6,7- tetrahydro- 4H- benzotriazol- 4- one
Smiles: O=C1CCC(c2c1nnn2c1nonc1N)(C)C

STK672664
Synonyms: 4- (4- methyl- 5- oxido- 1,2,5- oxadiazol- 3- yl)- 1,3- thiazol- 2- amine
Smiles: Nc1scc(n1)c1no[n+](c1C)[O-]

STK754285
Synonyms: 3- (methylsulfanyl)- N- [(E)- thiophen- 2- ylmethylidene]- 7H- [1,2,4]triazolo[4,3- b][1,2,4]triazol- 7- amine
Smiles: CSc1nnc2n1ncn2/N=C/c1cccs1

STK754291
Synonyms: N- (pyridin- 2- yl)- 2- (7H- [1,2,4]triazolo[4,3- b][1,2,4]triazol- 3- ylsulfanyl)acetamide
Smiles: O=C(Nc1ccccn1)CSc1nnc2n1nc[nH]2

STK672667
Synonyms: 2- [(7- amino- 7H- [1,2,4]triazolo[4,3- b][1,2,4]triazol- 3- yl)sulfanyl]- N- [2- (4- {3- [(7- amino- 7H- [1,2,4]triazolo[4,3- b][1,2,4]triazol- 3- yl)sulfanyl]- 2- oxopropyl}phenyl)- 1,3- benzoxazol- 5- yl]acetamide
Smiles: O=C(Cc1ccc(cc1)c1oc2c(n1)cc(cc2)NC(=O)CSc1nnc2n1ncn2N)CSc1nnc2n1ncn2N

STK754294
Synonyms: (1R,2R,5R)- 2- (phenylsulfanyl)- 6,8- dioxabicyclo[3.2.1]octan- 4- one(non- preferredname)
Smiles: O=C1C[C@@H](Sc2ccccc2)[C@@H]2O[C@H]1OC2

STK754295
Synonyms: 4- hydroxy- 3- (2- hydroxyethyl)- 4,5,5- trimethyl- 1,3- oxazolidin- 2- one
Smiles: OCCN1C(=O)OC(C1(C)O)(C)C

STK672668
Synonyms: (2'R,3'R)- 5'- amino- 2'- [(4- bromophenyl)carbonyl]- 2',3'- dihydro- 2,3'- bithiophene- 4'- carbonitrile(non- preferredname)
Smiles: N#CC1=C(N)S[C@H]([C@@H]1c1cccs1)C(=O)c1ccc(cc1)Br

STK754298
Synonyms: 3,3,3a- trimethyl- 3a,4- dihydro- 3H- [1,3]oxazolo[3,4- a]benzimidazol- 1- one
Smiles: O=C1OC(C2(N1c1ccccc1N2)C)(C)C

STK754305
Synonyms: quinolin- 8- yl4- bromo- 2- methylbenzenesulfonate
Smiles: Brc1ccc(c(c1)C)S(=O)(=O)Oc1cccc2c1nccc2

STK672671
Synonyms: 2,4- dibromo- N- (pyridin- 2- yl)benzenesulfonamide
Smiles: Brc1ccc(c(c1)Br)S(=O)(=O)Nc1ccccn1

STK754307
Synonyms: 2- (4- methoxy- 3- nitrophenyl)- 3- [(4- methylphenyl)sulfonyl]- 1,3- thiazolidine
Smiles: COc1ccc(cc1[N+](=O)[O-])C1SCCN1S(=O)(=O)c1ccc(cc1)C

STK754309
Synonyms: benzene- 1,3- diylbis[(4- methoxyphenyl)methanone]
Smiles: COc1ccc(cc1)C(=O)c1cccc(c1)C(=O)c1ccc(cc1)OC

STK672675
Synonyms: 2,8- bis(3- chloro- 2- methylphenyl)- 5- phenyl- 3a,4,6,6a,9a,10,10a,10b- octahydro- 6,10- ethenoisoindolo[5,6- e]isoindole- 1,3,7,9(2H,8H)- tetrone
Smiles: Clc1cccc(c1C)N1C(=O)C2C(C1=O)CC(=C1C2C2C=CC1C1C2C(=O)N(C1=O)c1cccc(c1C)Cl)c1ccccc1

STK754326
Synonyms: 2,7- dicyclooctylbenzo[lmn][3,8]phenanthroline- 1,3,6,8(2H,7H)- tetrone
Smiles: O=c1c2ccc3c4c2c(c(=O)n1C1CCCCCCC1)ccc4c(=O)n(c3=O)C1CCCCCCC1

STK672676
Synonyms: 3- [(4- methylpiperidin- 1- yl)carbonyl]- 2H- chromen- 2- one
Smiles: CC1CCN(CC1)C(=O)c1cc2ccccc2oc1=O

STK754345
Synonyms: 2- (4- iodophenyl)- 2- oxoethyl2- oxo- 2H- chromene- 3- carboxylate
Smiles: Ic1ccc(cc1)C(=O)COC(=O)c1cc2ccccc2oc1=O

STK754347
Synonyms: 6- bromo- 3- {2- [(4- methylphenyl)amino]- 1,3- thiazol- 4- yl}- 2H- chromen- 2- one
Smiles: Cc1ccc(cc1)Nc1scc(n1)c1cc2cc(Br)ccc2oc1=O

STK754353
Synonyms: 2- amino- 4- (4- methoxyphenyl)- 1- (4- methylphenyl)- 5- oxo- 1,4,5,6,7,8- hexahydroquinoline- 3- carbonitrile
Smiles: COc1ccc(cc1)C1C(=C(N)N(C2=C1C(=O)CCC2)c1ccc(cc1)C)C#N

STK672684
Synonyms: 2,2'- (oxydibenzene- 4,1- diyl)bis[N- (2,4- dioxo- 1,2,3,4- tetrahydropyrimidin- 5- yl)- 1,3- dioxo- 2,3- dihydro- 1H- isoindole- 5- carboxamide]
Smiles: O=c1[nH]cc(c(=O)[nH]1)NC(=O)c1ccc2c(c1)C(=O)N(C2=O)c1ccc(cc1)Oc1ccc(cc1)N1C(=O)c2c(C1=O)cc(cc2)C(=O)Nc1c[nH]c(=O)[nH]c1=O

STK754363
Synonyms: N- [2- (1H- indol- 3- yl)ethyl]- 3,5- dinitrobenzamide
Smiles: O=C(c1cc(cc(c1)[N+](=O)[O-])[N+](=O)[O-])NCCc1c[nH]c2c1cccc2

STK754366
Synonyms: 2- (3- {2- [(4- methylphenyl)amino]- 1,3- thiazol- 4- yl}phenyl)- 1H- isoindole- 1,3(2H)- dione
Smiles: Cc1ccc(cc1)Nc1scc(n1)c1cccc(c1)N1C(=O)c2c(C1=O)cccc2

STK754380
Synonyms: 4- (4- chlorophenyl)- 2- phenylphthalazine- 1(2H)- thione
Smiles: Clc1ccc(cc1)c1nn(c2ccccc2)c(=S)c2c1cccc2

STK754392
Synonyms: methyl6- methyl- 2- oxo- 4- {4- [2- oxo- 2- (piperidin- 1- yl)ethoxy]phenyl}- 1,2,3,4- tetrahydropyrimidine- 5- carboxylate
Smiles: COC(=O)C1=C(C)NC(=O)NC1c1ccc(cc1)OCC(=O)N1CCCCC1

STK672695
Synonyms: 5- acetylpyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: O=C1NC(=O)C(C(=O)N1)C(=O)C

STK672697
Synonyms: 3- methyl- 3- [(2- oxopropyl)amino]butan- 2- one
Smiles: CC(=O)CNC(C(=O)C)(C)C

STK672699
Synonyms: (3R,4S)- 2,3- dimethylpiperidin- 4- ol
Smiles: C[C@@H]1[C@@H](O)CCNC1C

STK672704
Synonyms: 1,2,5- trimethylpiperidin- 3- ol
Smiles: CC1CC(O)C(N(C1)C)C

STK672706
Synonyms: 1,2,5- trimethylpiperidin- 4- ol
Smiles: OC1CC(C)N(CC1C)C

STK672707
Synonyms: 1,2,3- trimethylpiperidin- 4- ol
Smiles: OC1CCN(C(C1C)C)C

STK754405
Synonyms: 2- bromo- N- (2- methylphenyl)butanamide
Smiles: CCC(C(=O)Nc1ccccc1C)Br

STK672714
Synonyms: 1,1'- buta- 1,3- diyne- 1,4- diylbis(4- methylbenzene)
Smiles: Cc1ccc(cc1)C#CC#Cc1ccc(cc1)C

STK754406
Synonyms: 2- cyano- N'- (propan- 2- ylidene)acetohydrazide
Smiles: N#CCC(=O)NN=C(C)C

STK754412
Synonyms: 5,5'- [benzene- 1,4- diylbis(methanediylsulfanediyl)]bis(1- phenyl- 1H- tetrazole)
Smiles: c1ccc(cc1)n1nnnc1SCc1ccc(cc1)CSc1nnnn1c1ccccc1

STK754414
Synonyms: (3Z)- 3- [(2- iodophenyl)imino]- 1,3- dihydro- 2H- indol- 2- one
Smiles: Ic1ccccc1/N=C/1\C(=O)Nc2c1cccc2

STK754418
Synonyms: (4Z,4'Z)- 2,2'- benzene- 1,4- diylbis{4- [(5- methylfuran- 2- yl)methylidene]- 1,3- oxazol- 5(4H)- one}
Smiles: Cc1ccc(o1)/C=C/1\N=C(OC1=O)c1ccc(cc1)C1=N/C(=C\c2ccc(o2)C)/C(=O)O1

STK754419
Synonyms: 4- chloro- 3- {[(2- methylphenoxy)acetyl]amino}- N- phenylbenzamide
Smiles: O=C(Nc1cc(ccc1Cl)C(=O)Nc1ccccc1)COc1ccccc1C

STK754428
Synonyms: quinolin- 8- yl4- methyl- 3- nitrobenzoate
Smiles: O=C(c1ccc(c(c1)[N+](=O)[O-])C)Oc1cccc2c1nccc2

STK672748
Synonyms: N- (4- chloro- 2- nitrophenyl)- 6- nitro- 1,2- benzothiazol- 3- amine1,1- dioxide
Smiles: Clc1ccc(c(c1)[N+](=O)[O-])NC1=NS(=O)(=O)c2c1ccc(c2)[N+](=O)[O-]

STK754445
Synonyms: N- (2- methoxy- 5- nitrophenyl)- 6- nitro- 1,2- benzothiazol- 3- amine1,1- dioxide
Smiles: COc1ccc(cc1NC1=NS(=O)(=O)c2c1ccc(c2)[N+](=O)[O-])[N+](=O)[O-]

STK672751
Synonyms: 1,4- bis[2- (phenylsulfanyl)ethyl]piperazine
Smiles: C(Sc1ccccc1)CN1CCN(CC1)CCSc1ccccc1

STK754462
Synonyms: 2- phenyl- N'- {(E)- [4- (propan- 2- yl)phenyl]methylidene}cyclopropanecarbohydrazide
Smiles: CC(c1ccc(cc1)/C=N/NC(=O)C1CC1c1ccccc1)C

STK754468
Synonyms: ethyl{2- methoxy- 4- [(2,4,6- trioxotetrahydropyrimidin- 5(2H)- ylidene)methyl]phenoxy}acetate
Smiles: CCOC(=O)COc1ccc(cc1OC)C=C1C(=O)NC(=O)NC1=O

STK754469
Synonyms: N- (2,3- dimethylphenyl)- N'- (4- iodophenyl)[1,2,5]oxadiazolo[3,4- b]pyrazine- 5,6- diamine
Smiles: Ic1ccc(cc1)Nc1nc2nonc2nc1Nc1cccc(c1C)C

STK754473
Synonyms: 4- {[(3E)- 5- nitro- 2- oxo- 1,2- dihydro- 3H- indol- 3- ylidene]amino}benzamide
Smiles: O=C1Nc2c(/C/1=N\c1ccc(cc1)C(=O)N)cc(cc2)[N+](=O)[O-]

STK754476
Synonyms: 3- methyl- 5- {(2E)- 2- [2- (trifluoromethyl)benzylidene]hydrazinyl}- N- {(Z)- [2- (trifluoromethyl)phenyl]methylidene}- 4H- 1,2,4- triazol- 4- amine
Smiles: Cc1nnc(n1/N=C\c1ccccc1C(F)(F)F)N/N=C/c1ccccc1C(F)(F)F

STK754478
Synonyms: 5- (3- methyl- 4- nitrophenyl)furan- 2- carbaldehyde
Smiles: O=Cc1ccc(o1)c1ccc(c(c1)C)[N+](=O)[O-]

STK754496
Synonyms: N- (4,5- dimethyl- 2- nitrophenyl)- 6- nitro- 1,2- benzothiazol- 3- amine1,1- dioxide
Smiles: Cc1cc(NC2=NS(=O)(=O)c3c2ccc(c3)[N+](=O)[O-])c(cc1C)[N+](=O)[O-]

STK754497
Synonyms: 6- nitro- N- [2- (propan- 2- yl)phenyl]- 1,2- benzothiazol- 3- amine1,1- dioxide
Smiles: CC(c1ccccc1NC1=NS(=O)(=O)c2c1ccc(c2)[N+](=O)[O-])C

STK754498
Synonyms: N- [1- acetyl- 3- (methylsulfanyl)- 1H- 1,2,4- triazol- 5- yl]acetamide
Smiles: CSc1nn(c(n1)NC(=O)C)C(=O)C

STK754500
Synonyms: N- (pyridin- 2- yl)- 2,3- dihydro- 1,4- benzodioxine- 2- carboxamide
Smiles: O=C(C1COc2c(O1)cccc2)Nc1ccccn1

STK754501
Synonyms: N- (2,3- dihydro- 1,4- benzodioxin- 2- ylmethyl)- 1- phenylcyclopentanecarboxamide
Smiles: O=C(C1(CCCC1)c1ccccc1)NCC1COc2c(O1)cccc2

STK672770
Synonyms: 1,2,3,4,5,6- hexahydro- 13H- cycloocta[c]indeno[2,1- e]pyridazin- 13- one
Smiles: O=C1c2c3CCCCCCc3nnc2c2c1cccc2

STK754516
Synonyms: 3- [(2- phenyl- 1,3- thiazolidin- 3- yl)carbonyl]- 2H- chromen- 2- one
Smiles: O=c1oc2ccccc2cc1C(=O)N1CCSC1c1ccccc1

STK672776
Synonyms: 2- nitro- N'- [(2E)- 4- oxo- 4- phenylbut- 2- en- 2- yl]benzohydrazide
Smiles: C/C(=C\C(=O)c1ccccc1)/NNC(=O)c1ccccc1[N+](=O)[O-]

STK754529
Synonyms: 1- [5- hydroxy- 5- (pyridin- 3- yl)- 3- (trifluoromethyl)- 4,5- dihydro- 1H- pyrazol- 1- yl]ethanone
Smiles: CC(=O)N1N=C(CC1(O)c1cccnc1)C(F)(F)F

STK672778
Synonyms: 2- (3,3- diethyl- 3,4- dihydroisoquinolin- 1- yl)- 1- (morpholin- 4- yl)ethanone
Smiles: CCC1(CC)Cc2ccccc2C(=N1)CC(=O)N1CCOCC1

STK672779
Synonyms: 1,3,5- tris[2- hydroxy- 3- (morpholin- 4- yl)propyl]pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: OC(CC1C(=O)N(CC(CN2CCOCC2)O)C(=O)N(C1=O)CC(CN1CCOCC1)O)CN1CCOCC1

STK754533
Synonyms: 7- [(2E)- 2- benzylidenehydrazinyl]- 1- ethyl- 6- fluoro- 4- oxo- 1,4- dihydroquinoline- 3- carboxylicacid
Smiles: CCn1cc(C(=O)O)c(=O)c2c1cc(N/N=C/c1ccccc1)c(c2)F

STK754538
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(9Z)- 2- nitro- 9H- fluoren- 9- ylidene]- 5- phenyl- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: [O-][N+](=O)c1ccc2c(c1)/C(=N\NC(=O)c1nnn(c1c1ccccc1)c1nonc1N)/c1c2cccc1

STK754572
Synonyms: N'- [(2E)- 1- (1H- benzotriazol- 1- yl)propan- 2- ylidene]benzohydrazide
Smiles: C/C(=N\NC(=O)c1ccccc1)/Cn1nnc2c1cccc2

STK754573
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [bis(4- fluorophenyl)methylidene]- 5- methyl- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: Fc1ccc(cc1)/C(=N/NC(=O)c1nnn(c1C)c1nonc1N)/c1ccc(cc1)F

STK754582
Synonyms: 4- {(Z)- [2- (1H- benzimidazol- 2- yl)hydrazinylidene]methyl}- 2- bromo- 6- methoxyphenol
Smiles: COc1cc(/C=N\Nc2nc3c([nH]2)cccc3)cc(c1O)Br

STK754586
Synonyms: N'- [(E)- (6- bromo- 1,3- benzodioxol- 5- yl)methylidene]- 9H- fluorene- 9- carbohydrazide
Smiles: O=C(C1c2ccccc2c2c1cccc2)N/N=C/c1cc2OCOc2cc1Br

STK754587
Synonyms: methyl4- [4- (2- methoxy- 2- oxoethoxy)phenyl]- 6- methyl- 2- oxo- 1,2,3,4- tetrahydropyrimidine- 5- carboxylate
Smiles: COC(=O)COc1ccc(cc1)C1NC(=O)NC(=C1C(=O)OC)C

STK672784
Synonyms: N- (1- acetyl- 2- methyl- 1,2,3,4- tetrahydroquinolin- 4- yl)- 3- methoxy- N- phenylbenzamide
Smiles: COc1cccc(c1)C(=O)N(C1CC(C)N(c2c1cccc2)C(=O)C)c1ccccc1

STK754605
Synonyms: 1- [1- (3- methylphenyl)- 1H- tetrazol- 5- yl]- N- [(E)- phenylmethylidene]cyclohexanamine
Smiles: Cc1cccc(c1)n1nnnc1C1(CCCCC1)/N=C/c1ccccc1

STK672799
Synonyms: 2- amino- 4- (4- bromothiophen- 2- yl)- 1- (3- methylphenyl)- 5- oxo- 1,4,5,6,7,8- hexahydroquinoline- 3- carbonitrile
Smiles: N#CC1=C(N)N(c2cccc(c2)C)C2=C(C1c1scc(c1)Br)C(=O)CCC2

STK754616
Synonyms: N- (2,6- dimethylphenyl)- 2- [(6- {[(E)- (2- hydroxynaphthalen- 1- yl)methylidene]amino}- 1,3- benzothiazol- 2- yl)sulfanyl]acetamide
Smiles: O=C(Nc1c(C)cccc1C)CSc1sc2c(n1)ccc(c2)/N=C/c1c(O)ccc2c1cccc2

STK672806
Synonyms: ethyl4- [(6- {(2E)- 2- [2- (trifluoromethyl)benzylidene]hydrazinyl}[1,2,5]oxadiazolo[3,4- b]pyrazin- 5- yl)amino]benzoate
Smiles: CCOC(=O)c1ccc(cc1)Nc1nc2nonc2nc1N/N=C/c1ccccc1C(F)(F)F

STK754636
Synonyms: 5- {4- [(2,4- dichlorobenzyl)oxy]- 3- methoxyphenyl}- 1,3,4- oxadiazol- 2- amine
Smiles: COc1cc(ccc1OCc1ccc(cc1Cl)Cl)c1nnc(o1)N

STK754643
Synonyms: N- (4- methoxyphenyl)- 3,5- bis(methylsulfanyl)- 1,2- thiazole- 4- carboxamide
Smiles: COc1ccc(cc1)NC(=O)c1c(SC)snc1SC

STK672814
Synonyms: 1- benzyl- 1H- 1,2,3- triazole- 4- carbonitrile
Smiles: N#Cc1nnn(c1)Cc1ccccc1

STK754644
Synonyms: N- [4- (1,3- dioxo- 1,3- dihydro- 2H- isoindol- 2- yl)- 1- (2H- tetrazol- 5- yl)butyl]acetamide
Smiles: CC(=O)NC(c1n[nH]nn1)CCCN1C(=O)c2c(C1=O)cccc2

STK754647
Synonyms: 3- {[2- (4- bromophenyl)- 1,3- thiazolidin- 3- yl]carbonyl}- 2H- chromen- 2- one
Smiles: Brc1ccc(cc1)C1SCCN1C(=O)c1cc2ccccc2oc1=O

STK754649
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- (4- fluorophenyl)methylidene]- 5- phenyl- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: Fc1ccc(cc1)/C=N/NC(=O)c1nnn(c1c1ccccc1)c1nonc1N

STK672817
Synonyms: tert- butyl1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- methyl- 1H- 1,2,3- triazole- 4- carboxylate
Smiles: O=C(c1nnn(c1C)c1nonc1N)OC(C)(C)C

STK754655
Synonyms: 6- bromo- 4- nitro- 2- oxo- 1,3- benzoxathiol- 5- ylmethylcarbonate
Smiles: COC(=O)Oc1c(Br)cc2c(c1[N+](=O)[O-])sc(=O)o2

STK754661
Synonyms: 1- [(5Z)- 4- (4- bromophenyl)- 5- (naphthalen- 1- ylimino)- 4,5- dihydro- 1,3,4- thiadiazol- 2- yl]ethanone
Smiles: Brc1ccc(cc1)n1nc(s/c/1=N\c1cccc2c1cccc2)C(=O)C

STK754662
Synonyms: 1- {3- [(4,6- dihydroxy- 2- sulfanylpyrimidin- 5- yl)methyl]- 4- ethoxyphenyl}ethanone
Smiles: CCOc1ccc(cc1Cc1c(O)nc(nc1O)S)C(=O)C

STK672820
Synonyms: N- [(2Z)- 2- (acetylamino)- 3- (4- fluorophenyl)prop- 2- enoyl]valine
Smiles: CC(C(C(=O)O)NC(=O)/C(=C/c1ccc(cc1)F)/NC(=O)C)C

STK754673
Synonyms: 6- (4- ethoxyphenyl)- 2- ethyl- 4,5- dihydropyridazin- 3(2H)- one
Smiles: CCOc1ccc(cc1)C1=NN(C(=O)CC1)CC

STK672823
Synonyms: 4- {[4- (1,3- dioxo- 1,3- dihydro- 2H- isoindol- 2- yl)butyl]amino}- 2- methyl- 1H- isoindole- 1,3(2H)- dione
Smiles: CN1C(=O)c2c(C1=O)c(NCCCCN1C(=O)c3c(C1=O)cccc3)ccc2

STK754675
Synonyms: N'- [(1E)- 6,7- dimethoxy- 3,4- dihydronaphthalen- 1(2H)- ylidene]- 2- (naphthalen- 1- yl)acetohydrazide
Smiles: COc1cc2/C(=N/NC(=O)Cc3cccc4c3cccc4)/CCCc2cc1OC

STK754678
Synonyms: 5- ethyl- 4- hydroxy- 4,5- dimethyl- 3- (pyridin- 3- ylmethyl)- 1,3- oxazolidin- 2- one
Smiles: CCC1(C)OC(=O)N(C1(C)O)Cc1cccnc1

STK754679
Synonyms: 4- hydroxy- 4,5,5- trimethyl- 3- (pyridin- 3- yl)- 1,3- oxazolidin- 2- one
Smiles: O=C1OC(C(N1c1cccnc1)(C)O)(C)C

STK754680
Synonyms: ethyl1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- (phenoxymethyl)- 1H- 1,2,3- triazole- 4- carboxylate
Smiles: CCOC(=O)c1nnn(c1COc1ccccc1)c1nonc1N

STK672826
Synonyms: ethyl1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- [(4- benzylpiperazin- 1- yl)methyl]- 1H- 1,2,3- triazole- 4- carboxylate
Smiles: CCOC(=O)c1nnn(c1CN1CCN(CC1)Cc1ccccc1)c1nonc1N

STK672827
Synonyms: ethyl1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- [(4- methylpiperidin- 1- yl)methyl]- 1H- 1,2,3- triazole- 4- carboxylate
Smiles: CCOC(=O)c1nnn(c1CN1CCC(CC1)C)c1nonc1N

STK672828
Synonyms: ethyl1- {[1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 4- (ethoxycarbonyl)- 1H- 1,2,3- triazol- 5- yl]methyl}piperidine- 4- carboxylate
Smiles: CCOC(=O)C1CCN(CC1)Cc1c(nnn1c1nonc1N)C(=O)OCC

STK672829
Synonyms: ethyl1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- [(diethylamino)methyl]- 1H- 1,2,3- triazole- 4- carboxylate
Smiles: CCOC(=O)c1nnn(c1CN(CC)CC)c1nonc1N

STK672830
Synonyms: ethyl1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- {[4- (2- hydroxyethyl)piperazin- 1- yl]methyl}- 1H- 1,2,3- triazole- 4- carboxylate
Smiles: OCCN1CCN(CC1)Cc1c(nnn1c1nonc1N)C(=O)OCC

STK754682
Synonyms: ethyl1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- (2,3- dihydro- 1H- indol- 1- ylmethyl)- 1H- 1,2,3- triazole- 4- carboxylate
Smiles: CCOC(=O)c1nnn(c1CN1CCc2c1cccc2)c1nonc1N

STK754683
Synonyms: ethyl1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- propyl- 1H- 1,2,3- triazole- 4- carboxylate
Smiles: CCCc1c(nnn1c1nonc1N)C(=O)OCC

STK754684
Synonyms: 4- (4- methyl- 1,2,5- oxadiazol- 3- yl)- 1,3- thiazol- 2- amine
Smiles: Nc1scc(n1)c1nonc1C

STK672832
Synonyms: N- [(E)- furan- 2- ylmethylidene]- 7H- [1,2,4]triazolo[4,3- b][1,2,4]triazol- 3- amine
Smiles: c1coc(c1)/C=N/c1nnc2n1nc[nH]2

STK754685
Synonyms: N~3~- [(E)- furan- 2- ylmethylidene]- 7H- [1,2,4]triazolo[4,3- b][1,2,4]triazole- 3,7- diamine
Smiles: Nn1cnn2c1nnc2/N=C/c1ccco1

STK754687
Synonyms: 5- ethyl- 4- hydroxy- 4,5- dimethyl- 3- (4H- 1,2,4- triazol- 4- yl)- 1,3- oxazolidin- 2- one
Smiles: CCC1(C)OC(=O)N(C1(C)O)n1cnnc1

STK754704
Synonyms: (2- thioxo- 1,3- benzoxazol- 3(2H)- yl)methylN'- phenylcarbamimidothioate
Smiles: N/C(=N/c1ccccc1)/SCn1c(=S)oc2c1cccc2

STK754712
Synonyms: 2,5- bis(3,4- dimethoxyphenyl)- 1,3,4- oxadiazole
Smiles: COc1cc(ccc1OC)c1nnc(o1)c1ccc(c(c1)OC)OC

STK672857
Synonyms: methyl(3E)- 3- [2- (4- nitrophenyl)hydrazinylidene]- 4- (phenylsulfanyl)butanoate
Smiles: COC(=O)C/C(=N\Nc1ccc(cc1)[N+](=O)[O-])/CSc1ccccc1

STK754714
Synonyms: (2E)- 2- [2- (4- fluorophenyl)hydrazinylidene]- 3- imino- 3- (piperidin- 1- yl)propanenitrile
Smiles: N#C/C(=N\Nc1ccc(cc1)F)/C(=N)N1CCCCC1

STK672860
Synonyms: 2- [(E)- {[2- (morpholin- 4- yl)phenyl]imino}methyl]- 6- nitrophenol
Smiles: [O-][N+](=O)c1cccc(c1O)/C=N/c1ccccc1N1CCOCC1

STK754732
Synonyms: N- [2- (4- tert- butylphenoxy)ethyl]- 2- nitro- 5- (piperidin- 1- yl)aniline
Smiles: [O-][N+](=O)c1ccc(cc1NCCOc1ccc(cc1)C(C)(C)C)N1CCCCC1

STK754736
Synonyms: 4- (1,3- dioxo- 1,3- dihydro- 2H- isoindol- 2- yl)- N- (4- methoxyphenyl)benzenesulfonamide
Smiles: COc1ccc(cc1)NS(=O)(=O)c1ccc(cc1)N1C(=O)c2c(C1=O)cccc2

STK754741
Synonyms: 2- {4- [(4- methylpiperidin- 1- yl)sulfonyl]phenyl}- 1H- isoindole- 1,3(2H)- dione
Smiles: CC1CCN(CC1)S(=O)(=O)c1ccc(cc1)N1C(=O)c2c(C1=O)cccc2

STK754755
Synonyms: N- (4- chloro- 2,5- dimethoxyphenyl)- 3- methyl- 4- nitro- 1H- pyrazol- 5- amine
Smiles: COc1cc(Cl)c(cc1Nc1[nH]nc(c1[N+](=O)[O-])C)OC

STK754758
Synonyms: 4- {4- [(1E)- 1- {(2E)- [1- (4- chlorophenyl)ethylidene]hydrazinylidene}ethyl]- 5- methyl- 1H- 1,2,3- triazol- 1- yl}- 1,2,5- oxadiazol- 3- amine
Smiles: Clc1ccc(cc1)/C(=N/N=C(/c1nnn(c1C)c1nonc1N)\C)/C

STK672870
Synonyms: N- (6- bromoquinolin- 8- yl)- 2- methylbenzenesulfonamide
Smiles: Brc1cc2cccnc2c(c1)NS(=O)(=O)c1ccccc1C

STK754763
Synonyms: 4- amino- N'- [(2,4- dichlorobenzyl)oxy]- N- (2- methylphenyl)- 1,2,5- oxadiazole- 3- carboximidamide
Smiles: Clc1ccc(c(c1)Cl)CO/N=C(/c1nonc1N)\Nc1ccccc1C

STK754768
Synonyms: (2E)- 2- [2- (2- fluorophenyl)hydrazinylidene]- 3- imino- 3- (piperidin- 1- yl)propanenitrile
Smiles: N#C/C(=N\Nc1ccccc1F)/C(=N)N1CCCCC1

STK754771
Synonyms: 2- (biphenyl- 4- yl)- 2- oxoethyl4- (1,3- dihydro- 2H- isoindol- 2- yl)benzoate
Smiles: O=C(c1ccc(cc1)N1Cc2c(C1)cccc2)OCC(=O)c1ccc(cc1)c1ccccc1

STK754777
Synonyms: 4- chloro- N- [5- (pyridin- 3- yl)- 1,3,4- thiadiazol- 2- yl]benzamide
Smiles: Clc1ccc(cc1)C(=O)Nc1nnc(s1)c1cccnc1

STK672882
Synonyms: N,N'- propane- 1,3- diylbis{2- [(2,5- dimethoxyphenyl)(phenylsulfonyl)amino]acetamide}(non- preferredname)
Smiles: COc1ccc(c(c1)N(S(=O)(=O)c1ccccc1)CC(=O)NCCCNC(=O)CN(S(=O)(=O)c1ccccc1)c1cc(OC)ccc1OC)OC

STK754796
Synonyms: N- (3- bromophenyl)- 4- (1,3- dioxo- 1,3- dihydro- 2H- isoindol- 2- yl)benzenesulfonamide
Smiles: Brc1cccc(c1)NS(=O)(=O)c1ccc(cc1)N1C(=O)c2c(C1=O)cccc2

STK754812
Synonyms: 2- chloro- 6- [(E)- {[2- phenoxy- 5- (trifluoromethyl)phenyl]imino}methyl]phenol
Smiles: Oc1c(cccc1Cl)/C=N/c1cc(ccc1Oc1ccccc1)C(F)(F)F

STK754819
Synonyms: 4- chloro- 2- [(E)- {[2- phenoxy- 5- (trifluoromethyl)phenyl]imino}methyl]phenol
Smiles: Clc1ccc(c(c1)/C=N/c1cc(ccc1Oc1ccccc1)C(F)(F)F)O

STK754820
Synonyms: 2,4- dichloro- 5- (morpholin- 4- ylsulfonyl)- N- (1,3- thiazol- 2- yl)benzamide
Smiles: O=C(c1cc(c(cc1Cl)Cl)S(=O)(=O)N1CCOCC1)Nc1nccs1

STK754824
Synonyms: (3Z)- 5- chloro- 3- [(4- chlorophenyl)imino]- 1,3- dihydro- 2H- indol- 2- one
Smiles: Clc1ccc(cc1)/N=C/1\C(=O)Nc2c1cc(Cl)cc2

STK754825
Synonyms: (3Z)- 3- [(2- methoxyphenyl)imino]- 5- methyl- 1,3- dihydro- 2H- indol- 2- one
Smiles: COc1ccccc1/N=C/1\C(=O)Nc2c1cc(C)cc2

STK672893
Synonyms: methyl6- methyl- 4- {4- [2- (morpholin- 4- yl)- 2- oxoethoxy]phenyl}- 2- oxo- 1,2,3,4- tetrahydropyrimidine- 5- carboxylate
Smiles: COC(=O)C1=C(C)NC(=O)NC1c1ccc(cc1)OCC(=O)N1CCOCC1

STK754840
Synonyms: 1- [(5Z)- 4- (3- chlorophenyl)- 5- (naphthalen- 1- ylimino)- 4,5- dihydro- 1,3,4- thiadiazol- 2- yl]ethanone
Smiles: Clc1cccc(c1)n1nc(s/c/1=N\c1cccc2c1cccc2)C(=O)C

STK672900
Synonyms: 5- bromo- 7- (morpholin- 4- ylmethyl)quinolin- 8- ol
Smiles: Oc1c(CN2CCOCC2)cc(c2c1nccc2)Br

STK754842
Synonyms: N- [2- (naphthalen- 1- yloxy)ethyl]- 2- nitro- 4- (trifluoromethyl)aniline
Smiles: [O-][N+](=O)c1cc(ccc1NCCOc1cccc2c1cccc2)C(F)(F)F

STK754848
Synonyms: 4- methoxyphenyl4- (2,5- dioxopyrrolidin- 1- yl)benzenesulfonate
Smiles: COc1ccc(cc1)OS(=O)(=O)c1ccc(cc1)N1C(=O)CCC1=O

STK672907
Synonyms: 3,3'- [benzene- 1,4- diylbis(oxy)]bis{1- [4- (4- nitrophenyl)piperazin- 1- yl]propan- 2- ol}
Smiles: OC(CN1CCN(CC1)c1ccc(cc1)[N+](=O)[O-])COc1ccc(cc1)OCC(CN1CCN(CC1)c1ccc(cc1)[N+](=O)[O-])O

STK672908
Synonyms: 5- (6,7- dimethoxy- 4- oxo- 4H- 3,1- benzoxazin- 2- yl)- 2- [4- (6,7- dimethoxy- 4- oxo- 4H- 3,1- benzoxazin- 2- yl)phenyl]- 1H- isoindole- 1,3(2H)- dione
Smiles: COc1cc2nc(oc(=O)c2cc1OC)c1ccc(cc1)N1C(=O)c2c(C1=O)ccc(c2)c1nc2cc(OC)c(cc2c(=O)o1)OC

STK754864
Synonyms: N- [3- cyano- 4,5- bis(4- methoxyphenyl)furan- 2- yl]- 2,2,2- trifluoroacetamide
Smiles: COc1ccc(cc1)c1c(oc(c1C#N)NC(=O)C(F)(F)F)c1ccc(cc1)OC

STK672912
Synonyms: 2- {[(4- chlorophenoxy)(hydroxy)phosphoryl]oxy}- 5- {6- [(phenylcarbonyl)amino]- 1,6- dihydro- 9H- purin- 9- yl}tetrahydrofuran- 3- yl4- oxopentanoate
Smiles: CC(=O)CCC(=O)OC1CC(OC1OP(=O)(Oc1ccc(cc1)Cl)O)n1cnc2c1N=CNC2NC(=O)c1ccccc1

STK754876
Synonyms: (3Z)- 5- chloro- 3- [(4- methoxyphenyl)imino]- 1,3- dihydro- 2H- indol- 2- one
Smiles: COc1ccc(cc1)/N=C/1\C(=O)Nc2c1cc(Cl)cc2

STK754878
Synonyms: [5- (4- chlorophenyl)- 5- hydroxy- 3- methyl- 4,5- dihydro- 1H- pyrazol- 1- yl](2- methylphenyl)methanone
Smiles: Clc1ccc(cc1)C1(O)CC(=NN1C(=O)c1ccccc1C)C

STK754879
Synonyms: [5- hydroxy- 5- methyl- 3- (trifluoromethyl)- 4,5- dihydro- 1H- pyrazol- 1- yl](2- hydroxyphenyl)methanone
Smiles: Oc1ccccc1C(=O)N1N=C(CC1(C)O)C(F)(F)F

STK672915
Synonyms: N- (3- methylphenyl)- 1- (2- oxoazetidin- 1- yl)cyclohexanecarboxamide
Smiles: Cc1cccc(c1)NC(=O)C1(CCCCC1)N1CCC1=O

STK754887
Synonyms: 6- bromo- 4- nitro- 2- oxo- 1,3- benzoxathiol- 5- yl2- chloroethylcarbonate
Smiles: ClCCOC(=O)Oc1c(Br)cc2c(c1[N+](=O)[O-])sc(=O)o2

STK754889
Synonyms: (2E)- 2- (1H- benzimidazol- 2- yl)- 3- [2- (propan- 2- yloxy)phenyl]prop- 2- enenitrile
Smiles: N#C/C(=C\c1ccccc1OC(C)C)/c1nc2c([nH]1)cccc2

STK672918
Synonyms: 3- amino- 4,6- dimethyl- 5- [(1E)- prop- 1- en- 1- yl]thieno[2,3- b]pyridine- 2- carbonitrile
Smiles: C/C=C/c1c(C)nc2c(c1C)c(N)c(s2)C#N

STK754895
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- methyl- N'- {(E)- [4- (methylsulfanyl)phenyl]methylidene}- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: CSc1ccc(cc1)/C=N/NC(=O)c1nnn(c1C)c1nonc1N

STK754897
Synonyms: N,N- dimethyl- 2- (1,3,5- trioxooctahydro- 2H- isoindol- 2- yl)acetamide
Smiles: O=C1CCC2C(C1)C(=O)N(C2=O)CC(=O)N(C)C

STK672920
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- [(diethylamino)methyl]- N'- [(1E)- 1- (4- hydroxyphenyl)ethylidene]- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: CCN(Cc1c(nnn1c1nonc1N)C(=O)N/N=C(/c1ccc(cc1)O)\C)CC

STK754901
Synonyms: 2- amino- 4- (5- bromothiophen- 2- yl)- 5- oxo- 1- [3- (trifluoromethyl)phenyl]- 1,4,5,6,7,8- hexahydroquinoline- 3- carbonitrile
Smiles: N#CC1=C(N)N(C2=C(C1c1ccc(s1)Br)C(=O)CCC2)c1cccc(c1)C(F)(F)F

STK754912
Synonyms: 3- (biphenyl- 4- yl)- 5H- indeno[1,2- c]pyridazin- 5- one
Smiles: O=C1c2cc(nnc2c2c1cccc2)c1ccc(cc1)c1ccccc1

STK672927
Synonyms: phenyl4- hydroxy- 2- [(3- methylphenyl)carbamoyl]pyrrolidine- 1- carboxylate
Smiles: OC1CC(N(C1)C(=O)Oc1ccccc1)C(=O)Nc1cccc(c1)C

STK672928
Synonyms: 1,3- bis{[(2- bromophenyl)amino]methyl}- 1,3- dihydro- 2H- benzimidazole- 2- thione
Smiles: Brc1ccccc1NCn1c(=S)n(c2c1cccc2)CNc1ccccc1Br

STK754937
Synonyms: methyl6- amino- 4- (3- chlorophenyl)- 5- cyano- 2- (methoxymethyl)- 4H- pyran- 3- carboxylate
Smiles: COCC1=C(C(=O)OC)C(C(=C(O1)N)C#N)c1cccc(c1)Cl

STK754952
Synonyms: 2- [(3- phenoxypropyl)sulfanyl]- 6- (thiophen- 2- yl)pyridine- 3- carbonitrile
Smiles: N#Cc1ccc(nc1SCCCOc1ccccc1)c1cccs1

STK754953
Synonyms: 2- [(2- phenylethyl)sulfanyl]- 6- (thiophen- 2- yl)pyridine- 3- carbonitrile
Smiles: N#Cc1ccc(nc1SCCc1ccccc1)c1cccs1

STK754954
Synonyms: 2- [(pyridin- 4- ylmethyl)sulfanyl]- 6- (thiophen- 2- yl)pyridine- 3- carbonitrile
Smiles: N#Cc1ccc(nc1SCc1ccncc1)c1cccs1

STK754957
Synonyms: (1S,2S,3aR)- 2- (4- methoxyphenyl)- 1- [(4- methoxyphenyl)carbonyl]- 1,2- dihydropyrrolo[1,2- a]quinoline- 3,3(3aH)- dicarbonitrile
Smiles: COc1ccc(cc1)C(=O)[C@H]1N2c3ccccc3C=C[C@@H]2C([C@@H]1c1ccc(cc1)OC)(C#N)C#N

STK754964
Synonyms: ethyl6- amino- 5- cyano- 2- methyl- 4- [3- (trifluoromethyl)phenyl]- 4H- pyran- 3- carboxylate
Smiles: CCOC(=O)C1=C(C)OC(=C(C1c1cccc(c1)C(F)(F)F)C#N)N

STK754972
Synonyms: 2- amino- 4- (2,4- difluorophenyl)- 4a,5,6,7- tetrahydronaphthalene- 1,3,3(4H)- tricarbonitrile
Smiles: N#CC1=C(N)C(C(C2C1=CCCC2)c1ccc(cc1F)F)(C#N)C#N

STK754978
Synonyms: 2- amino- 5- oxo- 7- phenyl- 4- [2- (trifluoromethyl)phenyl]- 5,6,7,8- tetrahydro- 4H- chromene- 3- carbonitrile
Smiles: N#CC1=C(N)OC2=C(C1c1ccccc1C(F)(F)F)C(=O)CC(C2)c1ccccc1

STK754981
Synonyms: ethyl(2Z)- 5- amino- 8- cyano- 3- oxo- 7- (pyridin- 3- yl)- 2- (pyridin- 3- ylmethylidene)- 2,3- dihydro- 7H- [1,3]thiazolo[3,2- a]pyridine- 6- carboxylate
Smiles: CCOC(=O)C1=C(N)n2c(=C(C1c1cccnc1)C#N)s/c(=C\c1cccnc1)/c2=O

STK754987
Synonyms: 3,5- bis{[2- (4- methylphenyl)- 2- oxoethyl]sulfanyl}- 1,2- thiazole- 4- carbonitrile
Smiles: N#Cc1c(SCC(=O)c2ccc(cc2)C)snc1SCC(=O)c1ccc(cc1)C

STK754996
Synonyms: (1S,2S,3aR)- 1- (2,2- dimethylpropanoyl)- 2- (pyridin- 3- yl)- 1,2- dihydropyrrolo[1,2- a]quinoline- 3,3(3aH)- dicarbonitrile
Smiles: N#CC1(C#N)[C@H](c2cccnc2)[C@H](N2[C@@H]1C=Cc1c2cccc1)C(=O)C(C)(C)C

STK672941
Synonyms: 6- nitro- 1,4- dihydropyrazolo[4,3- c]pyrazole- 3- carboxamide
Smiles: [O-][N+](=O)c1n[nH]c2c1[nH]nc2C(=O)N

STK672942
Synonyms: 3- nitro- 1H- pyrazole- 4- carbonitrile
Smiles: N#Cc1c[nH]nc1[N+](=O)[O-]

STK672945
Synonyms: N,N'- (3,3'- dimethoxybiphenyl- 4,4'- diyl)bis(3,6- diamino- 5- cyanothieno[2,3- b]pyridine- 2- carboxamide)
Smiles: COc1cc(ccc1NC(=O)c1sc2c(c1N)cc(c(n2)N)C#N)c1ccc(c(c1)OC)NC(=O)c1sc2c(c1N)cc(c(n2)N)C#N

STK755017
Synonyms: 5- ({[4- (morpholin- 4- ylsulfonyl)phenyl]amino}methylidene)- 2- thioxodihydropyrimidine- 4,6(1H,5H)- dione
Smiles: O=C1NC(=S)NC(=O)C1=CNc1ccc(cc1)S(=O)(=O)N1CCOCC1

STK672948
Synonyms: 1,2,2- trimethyl- 3- [(4- phenoxyphenyl)carbamoyl]cyclopentanecarboxylicacid
Smiles: O=C(C1CCC(C1(C)C)(C)C(=O)O)Nc1ccc(cc1)Oc1ccccc1

STK755025
Synonyms: 2- {[(E)- 2,2'- bithiophen- 5- ylmethylidene]amino}- 6- methyl- 4,5,6,7- tetrahydro- 1- benzothiophene- 3- carbonitrile
Smiles: N#Cc1c(/N=C/c2ccc(s2)c2cccs2)sc2c1CCC(C2)C

STK755028
Synonyms: N- [2- (1H- indol- 3- yl)ethyl]- 2,2- dimethylpropanamide
Smiles: O=C(C(C)(C)C)NCCc1c[nH]c2c1cccc2

STK755029
Synonyms: tert- butyl[2- (1H- indol- 3- yl)ethyl]carbamate
Smiles: O=C(OC(C)(C)C)NCCc1c[nH]c2c1cccc2

STK755046
Synonyms: methyl4- (2- chlorophenyl)- 2,5- dimethyl- 1H- pyrrole- 3- carboxylate
Smiles: COC(=O)c1c(C)[nH]c(c1c1ccccc1Cl)C

STK755047
Synonyms: dimethyl2- acetyl- 5- (2- chlorophenyl)- 3,6- dimethyl- 1,2- dihydropyridine- 2,4- dicarboxylate
Smiles: COC(=O)C1=C(C)C(NC(=C1c1ccccc1Cl)C)(C(=O)C)C(=O)OC

STK755052
Synonyms: N- [4- (dimethylamino)- 6- methoxy- 1,3,5- triazin- 2- yl]- N- [(1,3- dioxo- 1,3- dihydro- 2H- isoindol- 2- yl)methyl]- 4- methylbenzenesulfonamide
Smiles: COc1nc(nc(n1)N(S(=O)(=O)c1ccc(cc1)C)CN1C(=O)c2c(C1=O)cccc2)N(C)C

STK755060
Synonyms: ethyl6- methyl- 2- oxo- 4- {4- [2- oxo- 2- (piperidin- 1- yl)ethoxy]phenyl}- 1,2,3,4- tetrahydropyrimidine- 5- carboxylate
Smiles: CCOC(=O)C1=C(C)NC(=O)NC1c1ccc(cc1)OCC(=O)N1CCCCC1

STK755063
Synonyms: 2- (5- nitro- 2H- tetrazol- 2- yl)- N,N- diphenylacetamide
Smiles: O=C(N(c1ccccc1)c1ccccc1)Cn1nnc(n1)[N+](=O)[O-]

STK672965
Synonyms: 3,5- dibromo- N- [4- (5,7- dibromo- 6- {[(4- {[(E)- (2- hydroxyphenyl)methylidene]amino}phenyl)carbonyl]amino}- 1H- benzimidazol- 2- yl)phenyl]- 4- {[(E)- (2- hydroxyphenyl)methylidene]amino}benzamide
Smiles: O=C(c1ccc(cc1)/N=C/c1ccccc1O)Nc1c(Br)cc2c(c1Br)[nH]c(n2)c1ccc(cc1)NC(=O)c1cc(Br)c(c(c1)Br)/N=C/c1ccccc1O

STK755069
Synonyms: 2- amino- 4- phenyl- 6- (pyrrolidin- 1- yl)pyridine- 3,5- dicarbonitrile
Smiles: N#Cc1c(nc(c(c1c1ccccc1)C#N)N)N1CCCC1

STK755074
Synonyms: N'- (3- chloro- 4- methylphenyl)- N,N- diethyl- 6- [(2E)- 2- {[5- (4- nitrophenyl)furan- 2- yl]methylidene}hydrazinyl]- 1,3,5- triazine- 2,4- diamine
Smiles: CCN(c1nc(N/N=C/c2ccc(o2)c2ccc(cc2)[N+](=O)[O-])nc(n1)Nc1ccc(c(c1)Cl)C)CC

STK755081
Synonyms: 2- [(E)- (2- {4- [(4- fluorophenyl)amino]- 6- (morpholin- 4- yl)- 1,3,5- triazin- 2- yl}hydrazinylidene)methyl]phenol
Smiles: Fc1ccc(cc1)Nc1nc(N/N=C/c2ccccc2O)nc(n1)N1CCOCC1

STK672978
Synonyms: 4- [(E)- (2- {4- [(2- bromo- 4- methylphenyl)amino]- 6- (morpholin- 4- yl)- 1,3,5- triazin- 2- yl}hydrazinylidene)methyl]- 2- methoxyphenylacetate
Smiles: COc1cc(/C=N/Nc2nc(nc(n2)N2CCOCC2)Nc2ccc(cc2Br)C)ccc1OC(=O)C

STK755100
Synonyms: 4- [(2E)- 2- (1,3- benzodioxol- 5- ylmethylidene)hydrazinyl]- N- (4- fluorophenyl)- 6- (morpholin- 4- yl)- 1,3,5- triazin- 2- amine
Smiles: Fc1ccc(cc1)Nc1nc(N/N=C/c2ccc3c(c2)OCO3)nc(n1)N1CCOCC1

STK755110
Synonyms: 2- methoxy- 4- (morpholin- 4- yl)- 6- [(2E)- 2- {[5- (2- nitrophenyl)furan- 2- yl]methylidene}hydrazinyl]- 1,3,5- triazine
Smiles: COc1nc(N/N=C/c2ccc(o2)c2ccccc2[N+](=O)[O-])nc(n1)N1CCOCC1

STK755114
Synonyms: 3- [(E)- {2- [4- methoxy- 6- (morpholin- 4- yl)- 1,3,5- triazin- 2- yl]hydrazinylidene}methyl]- 2- methyl- 1H- indole
Smiles: COc1nc(N/N=C/c2c(C)[nH]c3c2cccc3)nc(n1)N1CCOCC1

STK672991
Synonyms: 2- [(E)- (2- {4- [(4- fluorophenyl)amino]- 6- (morpholin- 4- yl)- 1,3,5- triazin- 2- yl}hydrazinylidene)methyl]- 6- nitrophenol
Smiles: Fc1ccc(cc1)Nc1nc(N/N=C/c2cccc(c2O)[N+](=O)[O-])nc(n1)N1CCOCC1

STK755120
Synonyms: N- (4- fluorophenyl)- 4- {(2E)- 2- [(2- methyl- 1H- indol- 3- yl)methylidene]hydrazinyl}- 6- (morpholin- 4- yl)- 1,3,5- triazin- 2- amine
Smiles: Fc1ccc(cc1)Nc1nc(N/N=C/c2c(C)[nH]c3c2cccc3)nc(n1)N1CCOCC1

STK672996
Synonyms: N- benzyl- 4- (morpholin- 4- yl)- 6- [(2E)- 2- {[5- (4- nitrophenyl)furan- 2- yl]methylidene}hydrazinyl]- 1,3,5- triazin- 2- amine
Smiles: [O-][N+](=O)c1ccc(cc1)c1ccc(o1)/C=N/Nc1nc(NCc2ccccc2)nc(n1)N1CCOCC1

STK673000
Synonyms: 2,4- dibromo- 6- [(E)- (2- {4- (dimethylamino)- 6- [(4- fluorophenyl)amino]- 1,3,5- triazin- 2- yl}hydrazinylidene)methyl]benzene- 1,3- diol
Smiles: Fc1ccc(cc1)Nc1nc(N/N=C/c2cc(Br)c(c(c2O)Br)O)nc(n1)N(C)C

STK755130
Synonyms: N- (2- methylphenyl)- 6- {(2E)- 2- [(6- nitro- 1,3- benzodioxol- 5- yl)methylidene]hydrazinyl}[1,2,5]oxadiazolo[3,4- b]pyrazin- 5- amine
Smiles: [O-][N+](=O)c1cc2OCOc2cc1/C=N/Nc1nc2nonc2nc1Nc1ccccc1C

STK755131
Synonyms: 6- [(2E)- 2- (furan- 2- ylmethylidene)hydrazinyl]- N- (2- iodophenyl)[1,2,5]oxadiazolo[3,4- b]pyrazin- 5- amine
Smiles: Ic1ccccc1Nc1nc2nonc2nc1N/N=C/c1ccco1

STK673003
Synonyms: 6- [(2E)- 2- (1,3- benzodioxol- 5- ylmethylidene)hydrazinyl]- N- (2- methylphenyl)[1,2,5]oxadiazolo[3,4- b]pyrazin- 5- amine
Smiles: Cc1ccccc1Nc1nc2nonc2nc1N/N=C/c1ccc2c(c1)OCO2

STK755133
Synonyms: 6- [(2E)- 2- {[5- (4- bromophenyl)furan- 2- yl]methylidene}hydrazinyl]- N- (4- methylphenyl)[1,2,5]oxadiazolo[3,4- b]pyrazin- 5- amine
Smiles: Cc1ccc(cc1)Nc1nc2nonc2nc1N/N=C/c1ccc(o1)c1ccc(cc1)Br

STK755138
Synonyms: 5- {[5- (3- chloro- 4- methoxyphenyl)furan- 2- yl]methylidene}- 1,3- dimethylpyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: COc1ccc(cc1Cl)c1ccc(o1)C=C1C(=O)N(C)C(=O)N(C1=O)C

STK755139
Synonyms: 5- {[5- (3- chloro- 4- methylphenyl)furan- 2- yl]methylidene}- 2- thioxodihydropyrimidine- 4,6(1H,5H)- dione
Smiles: S=C1NC(=O)C(=Cc2ccc(o2)c2ccc(c(c2)Cl)C)C(=O)N1

STK755143
Synonyms: 5- (5- bromo- 2,4- dihydroxybenzylidene)- 1,3- dimethylpyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: CN1C(=O)N(C)C(=O)C(=Cc2cc(Br)c(cc2O)O)C1=O

STK673007
Synonyms: 3- butyl- 2,6- dioxo- 1,2,3,6- tetrahydropyrimidine- 4- carboxylicacid
Smiles: CCCCn1c(cc(=O)[nH]c1=O)C(=O)O

STK673009
Synonyms: 3- (3,5- dinitro- 1H- 1,2,4- triazol- 1- yl)propanoicacid
Smiles: OC(=O)CCn1nc(nc1[N+](=O)[O-])[N+](=O)[O-]

STK755166
Synonyms: 4- {(E)- [2- ({[(4- fluorophenyl)carbonyl]amino}acetyl)hydrazinylidene]methyl}- 2- methoxyphenylthiophene- 2- carboxylate(non- preferredname)
Smiles: COc1cc(/C=N/NC(=O)CNC(=O)c2ccc(cc2)F)ccc1OC(=O)c1cccs1

STK755167
Synonyms: 2- ethoxy- 4- [(E)- (2- {[(pyridin- 4- ylcarbonyl)amino]acetyl}hydrazinylidene)methyl]phenylthiophene- 2- carboxylate(non- preferredname)
Smiles: CCOc1cc(/C=N/NC(=O)CNC(=O)c2ccncc2)ccc1OC(=O)c1cccs1

STK755172
Synonyms: (3- ethyl- 5- hydroxy- 5- phenyl- 4,5- dihydro- 1H- pyrazol- 1- yl)(2- fluorophenyl)methanone
Smiles: CCC1=NN(C(C1)(O)c1ccccc1)C(=O)c1ccccc1F

STK755183
Synonyms: 2- amino- 4- (1,3- benzodioxol- 5- yl)- 1- (3- chloro- 2- methylphenyl)- 5- oxo- 1,4,5,6,7,8- hexahydroquinoline- 3- carbonitrile
Smiles: N#CC1=C(N)N(C2=C(C1c1ccc3c(c1)OCO3)C(=O)CCC2)c1cccc(c1C)Cl

STK755192
Synonyms: N- (4- methylphenyl)- Nalpha- (phenoxycarbonyl)tryptophanamide
Smiles: O=C(NC(C(=O)Nc1ccc(cc1)C)Cc1c[nH]c2c1cccc2)Oc1ccccc1

STK755197
Synonyms: quinolin- 8- yl3- (piperidin- 1- ylsulfonyl)benzoate
Smiles: O=C(c1cccc(c1)S(=O)(=O)N1CCCCC1)Oc1cccc2c1nccc2

STK755199
Synonyms: 3,4- dihydroquinolin- 1(2H)- yl[3- (piperidin- 1- ylsulfonyl)phenyl]methanone
Smiles: O=C(N1CCCc2c1cccc2)c1cccc(c1)S(=O)(=O)N1CCCCC1

STK755202
Synonyms: N- (3- methylphenyl)- Nalpha- (phenoxycarbonyl)tryptophanamide
Smiles: O=C(NC(C(=O)Nc1cccc(c1)C)Cc1c[nH]c2c1cccc2)Oc1ccccc1

STK755203
Synonyms: N- (2- methylphenyl)- Nalpha- (phenoxycarbonyl)tryptophanamide
Smiles: O=C(NC(C(=O)Nc1ccccc1C)Cc1c[nH]c2c1cccc2)Oc1ccccc1

STK755204
Synonyms: N- (3,4- dimethylphenyl)- Nalpha- (phenoxycarbonyl)tryptophanamide
Smiles: O=C(NC(C(=O)Nc1ccc(c(c1)C)C)Cc1c[nH]c2c1cccc2)Oc1ccccc1

STK755220
Synonyms: N- phenyl- 3b,6,6a,7,9,9a,10,12a- octahydrocyclopenta[c]cyclopenta[4,5]pyrido[3,2,1- ij]quinoline- 2- carboxamide
Smiles: O=C(c1cc2C3C=CCC3CN3c2c(c1)C1C=CCC1C3)Nc1ccccc1

STK755222
Synonyms: (3E)- N- (2- methoxybenzyl)- 3- (2- {[(2- methoxy- 5- methylphenyl)amino](oxo)acetyl}hydrazinylidene)butanamide
Smiles: COc1ccccc1CNC(=O)C/C(=N/NC(=O)C(=O)Nc1cc(C)ccc1OC)/C

STK755223
Synonyms: 2- [(6- {[(E)- (4- chlorophenyl)methylidene]amino}- 1,3- benzothiazol- 2- yl)sulfanyl]- N- phenylacetamide
Smiles: O=C(Nc1ccccc1)CSc1nc2c(s1)cc(cc2)/N=C/c1ccc(cc1)Cl

STK755224
Synonyms: 2- [(6- {[(E)- (2- hydroxynaphthalen- 1- yl)methylidene]amino}- 1,3- benzothiazol- 2- yl)sulfanyl]- N- phenylacetamide
Smiles: O=C(Nc1ccccc1)CSc1sc2c(n1)ccc(c2)/N=C/c1c(O)ccc2c1cccc2

STK755229
Synonyms: N'- [(E)- (2- hydroxyphenyl)methylidene]- 8- methyl- 1,2- bis(propylsulfonyl)indolizine- 3- carbohydrazide
Smiles: CCCS(=O)(=O)c1c(C(=O)N/N=C/c2ccccc2O)n2c(c1S(=O)(=O)CCC)c(C)ccc2

STK673028
Synonyms: 4- bromo- 2,3,5,6- tetramethylbenzyldiethylcarbamodithioate
Smiles: CCN(C(=S)SCc1c(C)c(C)c(c(c1C)C)Br)CC

STK755239
Synonyms: 3,4- dihydroquinolin- 1(2H)- yl[3- (morpholin- 4- ylsulfonyl)phenyl]methanone
Smiles: O=C(N1CCCc2c1cccc2)c1cccc(c1)S(=O)(=O)N1CCOCC1

STK673032
Synonyms: 2- oxo- 2- (10H- phenothiazin- 10- yl)ethylfuran- 2- carboxylate
Smiles: O=C(c1ccco1)OCC(=O)N1c2ccccc2Sc2c1cccc2

STK755244
Synonyms: N- [3- ({[(E)- amino(4- amino- 1,2,5- oxadiazol- 3- yl)methylidene]amino}oxy)- 3- oxo- 1- phenylpropyl]- 2,2,2- trifluoroacetamide
Smiles: O=C(O/N=C(\c1nonc1N)/N)CC(c1ccccc1)NC(=O)C(F)(F)F

STK673034
Synonyms: 2- (1H- benzimidazol- 2- ylsulfanyl)- 1- (octahydroquinolin- 1(2H)- yl)ethanone
Smiles: O=C(N1CCCC2C1CCCC2)CSc1nc2c([nH]1)cccc2

STK673035
Synonyms: N- [4- (4- bromophenyl)- 1,3- thiazol- 2- yl]- 2- [(6- methyl- 5- oxo- 4,5- dihydro- 1,2,4- triazin- 3- yl)sulfanyl]acetamide
Smiles: O=C(Nc1scc(n1)c1ccc(cc1)Br)CSc1nnc(c(=O)[nH]1)C

STK673036
Synonyms: 2- [({3- [(trifluoroacetyl)amino]phenyl}carbonyl)amino]- 4,5,6,7- tetrahydro- 1- benzothiophene- 3- carboxamide
Smiles: O=C(c1cccc(c1)NC(=O)C(F)(F)F)Nc1sc2c(c1C(=O)N)CCCC2

STK755252
Synonyms: phenyl2- [(3,4- dimethylphenyl)carbamoyl]- 4- hydroxypyrrolidine- 1- carboxylate
Smiles: OC1CC(N(C1)C(=O)Oc1ccccc1)C(=O)Nc1ccc(c(c1)C)C

STK755254
Synonyms: N'- [(1E)- 6- methoxy- 8- methyl- 3,4- dihydronaphthalen- 1(2H)- ylidene]- 2- (quinolin- 8- ylsulfanyl)acetohydrazide
Smiles: COc1cc(C)c2c(c1)CCC/C/2=N\NC(=O)CSc1cccc2c1nccc2

STK755270
Synonyms: 2- oxo- 2- [(4- sulfamoylphenyl)amino]ethyl(2,5- dioxopyrrolidin- 1- yl)acetate
Smiles: O=C(Nc1ccc(cc1)S(=O)(=O)N)COC(=O)CN1C(=O)CCC1=O

STK755271
Synonyms: N- (5- bromopyridin- 2- yl)- 2- [(6- methyl- 5- oxo- 4,5- dihydro- 1,2,4- triazin- 3- yl)sulfanyl]acetamide
Smiles: O=C(Nc1ccc(cn1)Br)CSc1nnc(c(=O)[nH]1)C

STK755277
Synonyms: 4,6- di(morpholin- 4- yl)- N- (pyridin- 3- ylmethyl)- 1,3,5- triazin- 2- amine
Smiles: O1CCN(CC1)c1nc(NCc2cccnc2)nc(n1)N1CCOCC1

STK755280
Synonyms: ethyl4- (3,5- dichlorothiophen- 2- yl)- 2- methyl- 5- oxo- 1,4,5,6,7,8- hexahydroquinoline- 3- carboxylate
Smiles: CCOC(=O)C1=C(C)NC2=C(C1c1sc(cc1Cl)Cl)C(=O)CCC2

STK673048
Synonyms: (1S,2S,4S,6R)- 3- (phenylcarbonyl)- 7,9- dioxatricyclo[4.2.1.0~2,4~]nonan- 5- one
Smiles: O=C1[C@@H]2OC[C@@H](O2)[C@@H]2[C@H]1C2C(=O)c1ccccc1

STK673049
Synonyms: (1S,2R,4S,6R)- 3- (thiophen- 2- ylcarbonyl)- 7,9- dioxatricyclo[4.2.1.0~2,4~]nonan- 5- one
Smiles: O=C1[C@@H]2OC[C@@H](O2)[C@@H]2C1[C@@H]2C(=O)c1cccs1

STK755301
Synonyms: N'- {(E)- [5- (4,5- dimethyl- 2- nitrophenyl)furan- 2- yl]methylidene}pyridine- 3- carbohydrazide
Smiles: O=C(c1cccnc1)N/N=C/c1ccc(o1)c1cc(C)c(cc1[N+](=O)[O-])C

STK673060
Synonyms: 2- [(E)- (2- {4- (4- benzylpiperidin- 1- yl)- 6- [(4- methylphenyl)amino]- 1,3,5- triazin- 2- yl}hydrazinylidene)methyl]- 6- nitrophenol
Smiles: Cc1ccc(cc1)Nc1nc(nc(n1)N/N=C/c1cccc(c1O)[N+](=O)[O-])N1CCC(CC1)Cc1ccccc1

STK755325
Synonyms: 1- amino- 3- [4- (propan- 2- yl)phenyl]pyrido[1,2- a]benzimidazole- 2,4- dicarbonitrile
Smiles: N#Cc1c(c2ccc(cc2)C(C)C)c(C#N)c2n(c1N)c1ccccc1n2

STK755339
Synonyms: 2- amino- 10- hydroxy- 4- phenyl- 4H- benzo[g]chromene- 3- carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1ccccc1)cc1c(c2O)cccc1

STK755340
Synonyms: methyl6- amino- 4- (3- bromo- 4- fluorophenyl)- 5- cyano- 2- (methoxymethyl)- 4H- pyran- 3- carboxylate
Smiles: COCC1=C(C(=O)OC)C(C(=C(O1)N)C#N)c1ccc(c(c1)Br)F

STK755341
Synonyms: methyl6- amino- 4- (2- chloro- 6- fluorophenyl)- 5- cyano- 2- (methoxymethyl)- 4H- pyran- 3- carboxylate
Smiles: COCC1=C(C(=O)OC)C(C(=C(O1)N)C#N)c1c(F)cccc1Cl

STK755343
Synonyms: methyl6- amino- 5- cyano- 2- (methoxymethyl)- 4- [2- (trifluoromethyl)phenyl]- 4H- pyran- 3- carboxylate
Smiles: COCC1=C(C(=O)OC)C(C(=C(O1)N)C#N)c1ccccc1C(F)(F)F

STK755347
Synonyms: methyl6- amino- 5- cyano- 4- (2- fluorophenyl)- 2- (methoxymethyl)- 4H- pyran- 3- carboxylate
Smiles: COCC1=C(C(=O)OC)C(C(=C(O1)N)C#N)c1ccccc1F

STK755365
Synonyms: 2- [(2- chlorobenzyl)sulfanyl]- 4- (4- fluorophenyl)- 6- (thiophen- 2- yl)pyridine- 3- carbonitrile
Smiles: N#Cc1c(SCc2ccccc2Cl)nc(cc1c1ccc(cc1)F)c1cccs1

STK673075
Synonyms: 4- (4- methoxyphenyl)- 6- methyl- 2- [(pyridin- 3- ylmethyl)sulfanyl]pyridine- 3- carbonitrile
Smiles: N#Cc1c(SCc2cccnc2)nc(cc1c1ccc(cc1)OC)C

STK755377
Synonyms: 2- {[3- cyano- 4- (4- fluorophenyl)- 6- phenylpyridin- 2- yl]sulfanyl}- N- (tricyclo[3.3.1.1~3,7~]dec- 1- yl)acetamide
Smiles: N#Cc1c(SCC(=O)NC23CC4CC(C3)CC(C2)C4)nc(cc1c1ccc(cc1)F)c1ccccc1

STK755378
Synonyms: 3- amino- 4- (4- fluorophenyl)- 6- phenyl- N- [3- (trifluoromethyl)phenyl]thieno[2,3- b]pyridine- 2- carboxamide
Smiles: Fc1ccc(cc1)c1cc(nc2c1c(N)c(s2)C(=O)Nc1cccc(c1)C(F)(F)F)c1ccccc1

STK755381
Synonyms: 4- (4- fluorophenyl)- 2- [(2- phenoxyethyl)sulfanyl]- 6- phenylpyridine- 3- carbonitrile
Smiles: N#Cc1c(SCCOc2ccccc2)nc(cc1c1ccc(cc1)F)c1ccccc1

STK673079
Synonyms: (8S,8aS)- 6- amino- 8- (2- bromophenyl)- 7,7- dicyano- 2- methyl- 1,2,3,7,8,8a- hexahydroisoquinoline- 5- carboxylicacid
Smiles: N#CC1(C#N)C(=C(C(=O)O)C2=CCN(C[C@H]2[C@@H]1c1ccccc1Br)C)N

STK673082
Synonyms: (8R,8aS)- 6- amino- 7,7- dicyano- 2- methyl- 8- (pyridin- 4- yl)- 1,2,3,7,8,8a- hexahydroisoquinoline- 5- carboxylicacid
Smiles: N#CC1(C#N)[C@@H](c2ccncc2)[C@@H]2CN(C)CC=C2C(=C1N)C(=O)O

STK673084
Synonyms: (8R,8aS)- 6- amino- 7,7- dicyano- 8- [4- (methylsulfanyl)phenyl]- 2- (propan- 2- yl)- 1,2,3,7,8,8a- hexahydroisoquinoline- 5- carboxylicacid
Smiles: N#CC1(C#N)[C@@H](c2ccc(cc2)SC)[C@@H]2CN(CC=C2C(=C1N)C(=O)O)C(C)C

STK755388
Synonyms: 2- [(6- {[(E)- (5- chloro- 2- hydroxyphenyl)methylidene]amino}- 1,3- benzothiazol- 2- yl)sulfanyl]- N- (2,6- diethylphenyl)acetamide
Smiles: CCc1cccc(c1NC(=O)CSc1sc2c(n1)ccc(c2)/N=C/c1cc(Cl)ccc1O)CC

STK755400
Synonyms: (3E)- N- [4- (acetylamino)phenyl]- 3- {2- [(4- tert- butylphenyl)carbonyl]hydrazinylidene}butanamide
Smiles: O=C(C/C(=N/NC(=O)c1ccc(cc1)C(C)(C)C)/C)Nc1ccc(cc1)NC(=O)C

STK755401
Synonyms: N- (4- methoxyphenyl)- 4- (trans- 4- propylcyclohexyl)benzamide
Smiles: CCC[C@@H]1CC[C@H](CC1)c1ccc(cc1)C(=O)Nc1ccc(cc1)OC

STK755404
Synonyms: N- (3- hydrazinyl- 3- oxopropyl)- 2- (2- methylpropoxy)benzamide(non- preferredname)
Smiles: NNC(=O)CCNC(=O)c1ccccc1OCC(C)C

STK673091
Synonyms: ethyl1- {2- [(5- chloro- 2- methoxyphenyl)amino]- 2- oxoethyl}- 4- phenylpiperidine- 4- carboxylate
Smiles: CCOC(=O)C1(CCN(CC1)CC(=O)Nc1cc(Cl)ccc1OC)c1ccccc1

STK755405
Synonyms: 3- [(2E)- 2- (5- bromo- 2,3- dimethoxybenzylidene)- 1- methylhydrazinyl]- 6- nitro- 1,2- benzothiazole1,1- dioxide
Smiles: COc1cc(Br)cc(c1OC)/C=N/N(C1=NS(=O)(=O)c2c1ccc(c2)[N+](=O)[O-])C

STK755413
Synonyms: 2- [(E)- ({2- [(4- bromobenzyl)sulfanyl]- 1,3- benzothiazol- 6- yl}imino)methyl]phenol
Smiles: Brc1ccc(cc1)CSc1nc2c(s1)cc(cc2)/N=C/c1ccccc1O

STK755432
Synonyms: phenyl(4- phenyl- 1,3- thiazol- 2- yl)carbamate
Smiles: O=C(Nc1scc(n1)c1ccccc1)Oc1ccccc1

STK755433
Synonyms: (5E)- 5- (furan- 2- ylmethylidene)- 1- (3- methoxyphenyl)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: COc1cccc(c1)N1C(=O)NC(=O)/C(=C\c2ccco2)/C1=O

STK755459
Synonyms: ethyl2- (butanoylamino)- N- [4- chloro- 2- (trifluoromethyl)phenyl]- 3,3,3- trifluoroalaninate
Smiles: CCCC(=O)NC(C(F)(F)F)(C(=O)OCC)Nc1ccc(cc1C(F)(F)F)Cl

STK673112
Synonyms: (3Z)- 3- [(4- ethoxyphenyl)imino]- 1- [(4- methylpiperidin- 1- yl)methyl]- 1,3- dihydro- 2H- indol- 2- one
Smiles: CCOc1ccc(cc1)/N=C/1\C(=O)N(c2c1cccc2)CN1CCC(CC1)C

STK673113
Synonyms: 2- [(3,5- dibromo- 4- hydroxyphenyl)(2- hydroxy- 4,4- dimethyl- 6- oxocyclohex- 1- en- 1- yl)methyl]- 5,5- dimethylcyclohexane- 1,3- dione
Smiles: O=C1CC(C)(C)CC(=O)C1C(C1=C(O)CC(CC1=O)(C)C)c1cc(Br)c(c(c1)Br)O

STK673116
Synonyms: 2- {(2- hydroxy- 4,4- dimethyl- 6- oxocyclohex- 1- en- 1- yl)[3- methoxy- 4- (prop- 2- en- 1- yloxy)phenyl]methyl}- 5,5- dimethylcyclohexane- 1,3- dione
Smiles: C=CCOc1ccc(cc1OC)C(C1=C(O)CC(CC1=O)(C)C)C1C(=O)CC(CC1=O)(C)C

STK673117
Synonyms: ethyl{4- [(4,4- dimethyl- 2,6- dioxocyclohexyl)(2- hydroxy- 4,4- dimethyl- 6- oxocyclohex- 1- en- 1- yl)methyl]phenoxy}acetate
Smiles: CCOC(=O)COc1ccc(cc1)C(C1=C(O)CC(CC1=O)(C)C)C1C(=O)CC(CC1=O)(C)C

STK673118
Synonyms: methyl{4- [(4,4- dimethyl- 2,6- dioxocyclohexyl)(2- hydroxy- 4,4- dimethyl- 6- oxocyclohex- 1- en- 1- yl)methyl]phenoxy}acetate
Smiles: COC(=O)COc1ccc(cc1)C(C1=C(O)CC(CC1=O)(C)C)C1C(=O)CC(CC1=O)(C)C

STK755495
Synonyms: 2- {[(E)- thiophen- 2- ylmethylidene]amino}- 4,5,6,7- tetrahydro- 1- benzothiophene- 3- carbonitrile
Smiles: N#Cc1c(/N=C/c2cccs2)sc2c1CCCC2

STK755498
Synonyms: N'- [(E)- furan- 2- ylmethylidene]- 2- (pyrimidin- 2- ylsulfanyl)acetohydrazide
Smiles: O=C(CSc1ncccn1)N/N=C/c1ccco1

STK755502
Synonyms: 5- amino- 2- chloro- 4- (methoxymethyl)- 6- methylpyridine- 3- carbonitrile
Smiles: COCc1c(N)c(C)nc(c1C#N)Cl

STK755505
Synonyms: 6- methyl- 11H- indeno[1,2- b]quinoxalin- 11- one
Smiles: O=C1c2ccccc2c2c1nc1cccc(c1n2)C

STK755506
Synonyms: 2- methyl- N- [(9Z)- 3- methyl- 9H- indeno[2,1- c]pyridin- 9- ylidene]aniline
Smiles: Cc1ncc2c(c1)c1ccccc1/C/2=N/c1ccccc1C

STK755508
Synonyms: 5- nitro- 2- (5- nitrofuran- 2- yl)- 1H- benzimidazole
Smiles: [O-][N+](=O)c1ccc(o1)c1nc2c([nH]1)ccc(c2)[N+](=O)[O-]

STK755509
Synonyms: N- [(11E)- 11H- indeno[1,2- b]quinolin- 11- ylidene]- 3- methylaniline
Smiles: Cc1cccc(c1)/N=C\1/c2cc3ccccc3nc2c2c1cccc2

STK673121
Synonyms: 3,3'- (11H- indeno[1,2- b]quinoline- 11,11- diyl)dipropanenitrile
Smiles: N#CCCC1(CCC#N)c2cc3ccccc3nc2c2c1cccc2

STK673122
Synonyms: diethyl2,3,5,6- tetrabromo- 2,6- dimethyl- 4- phenylpiperidine- 3,5- dicarboxylate
Smiles: CCOC(=O)C1(Br)C(c2ccccc2)C(Br)(C(=O)OCC)C(NC1(C)Br)(C)Br

STK755511
Synonyms: N- [(5E)- 9- methyl- 5H- indeno[1,2- b]pyridin- 5- ylidene]aniline
Smiles: Cc1cccc2c1c1ncccc1/C/2=N/c1ccccc1

STK755513
Synonyms: 6- methyl- 2- (pyridin- 3- yl)- 1H- indole
Smiles: Cc1ccc2c(c1)[nH]c(c2)c1cccnc1

STK755516
Synonyms: 3- methyl- 2- (4- methylphenyl)- 1H- indole
Smiles: Cc1ccc(cc1)c1[nH]c2c(c1C)cccc2

STK673124
Synonyms: 4- [(tricyclo[3.3.1.1~3,7~]dec- 1- ylcarbonyl)amino]benzoicacid
Smiles: O=C(C12CC3CC(C2)CC(C1)C3)Nc1ccc(cc1)C(=O)O

STK755521
Synonyms: N~2~,N~6~- bis[(benzyloxy)carbonyl]- N- (2,5- dimethylphenyl)lysinamide
Smiles: O=C(OCc1ccccc1)NCCCCC(C(=O)Nc1cc(C)ccc1C)NC(=O)OCc1ccccc1

STK755542
Synonyms: N- (4- {2- [(2- methoxyphenyl)amino]- 1,3- thiazol- 4- yl}phenyl)benzamide
Smiles: COc1ccccc1Nc1scc(n1)c1ccc(cc1)NC(=O)c1ccccc1

STK755556
Synonyms: ethyl4- (4- chlorophenyl)- 5- cyano- 2- methyl- 6- thioxo- 1,6- dihydropyridine- 3- carboxylate
Smiles: CCOC(=O)c1c(C)[nH]c(=S)c(c1c1ccc(cc1)Cl)C#N

STK673143
Synonyms: 4- {3- [(N,N'- diphenylcarbamimidoyl)sulfanyl]- 2,5- dioxopyrrolidin- 1- yl}benzoicacid
Smiles: OC(=O)c1ccc(cc1)N1C(=O)CC(C1=O)S/C(=N\c1ccccc1)/Nc1ccccc1

STK755566
Synonyms: N- benzyl- 2- [(6- {[(E)- (2,4- dichlorophenyl)methylidene]amino}- 1,3- benzothiazol- 2- yl)sulfanyl]acetamide
Smiles: O=C(NCc1ccccc1)CSc1nc2c(s1)cc(cc2)/N=C/c1ccc(cc1Cl)Cl

STK755568
Synonyms: 2,3- dimethyl- 9H- fluoren- 9- one
Smiles: O=C1c2ccccc2c2c1cc(C)c(c2)C

STK755572
Synonyms: diethyl3,3'- (11H- indeno[1,2- b]quinoline- 11,11- diyl)dipropanoate
Smiles: CCOC(=O)CCC1(CCC(=O)OCC)c2cc3ccccc3nc2c2c1cccc2

STK755576
Synonyms: 5- methyl- 2- (pyridin- 4- yl)- 1H- indole
Smiles: Cc1ccc2c(c1)cc([nH]2)c1ccncc1

STK673147
Synonyms: 2- methyl- 11H- indeno[1,2- b]quinoxaline
Smiles: Cc1ccc2c(c1)Cc1c2nc2c(n1)cccc2

STK755578
Synonyms: 2- (2,4- dimethylphenyl)- 1H- indole
Smiles: Cc1ccc(c(c1)C)c1cc2c([nH]1)cccc2

STK755579
Synonyms: N- [(9Z)- 3,7- dimethyl- 9H- indeno[2,1- c]pyridin- 9- ylidene]aniline
Smiles: Cc1ccc2c(c1)/C(=N/c1ccccc1)/c1c2cc(nc1)C

STK673150
Synonyms: 1,2,5- trimethyl- N- phenylpiperidin- 4- amine
Smiles: CC1CN(C)C(CC1Nc1ccccc1)C

STK755581
Synonyms: 4- (4- ethylbenzyl)- 1,2,5- trimethylpiperidin- 4- ylpropanoate
Smiles: CCC(=O)OC1(Cc2ccc(cc2)CC)CC(C)N(CC1C)C

STK755583
Synonyms: 7- methyl- 8- nitro- 5H- indeno[1,2- b]pyridine
Smiles: [O-][N+](=O)c1cc2c(cc1C)Cc1c2nccc1

STK755584
Synonyms: N- [(5Z)- 5H- indeno[1,2- b]pyridin- 5- ylidene]- 4- methylaniline
Smiles: Cc1ccc(cc1)/N=C\1/c2ccccc2c2c1cccn2

STK755587
Synonyms: 2- (morpholin- 4- yl)- N- (4- {5- [(morpholin- 4- ylacetyl)amino]- 1,3- benzoxazol- 2- yl}phenyl)acetamide
Smiles: O=C(Nc1ccc(cc1)c1oc2c(n1)cc(cc2)NC(=O)CN1CCOCC1)CN1CCOCC1

STK755589
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- (4- nitrophenyl)- N'- [(E)- (3- nitrophenyl)methylidene]- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: Nc1nonc1n1nnc(c1c1ccc(cc1)[N+](=O)[O-])C(=O)N/N=C/c1cccc(c1)[N+](=O)[O-]

STK755591
Synonyms: N,N'- [(2,5- dimethylthiene- 3,4- diyl)dimethanediyl]dianiline
Smiles: Cc1sc(c(c1CNc1ccccc1)CNc1ccccc1)C

STK673161
Synonyms: (1Z,1'E)- 1,1'- [(2Z,3E)- 1,1,1,5,5,5- hexafluoro- 4- (trifluoromethyl)pentane- 2,3- diylidene]dihydrazine
Smiles: N/N=C(\C(C(F)(F)F)C(F)(F)F)/C(=N/N)/C(F)(F)F

STK755596
Synonyms: 2,3- dihydrobenzo[g]quinolin- 4(1H)- one
Smiles: O=C1CCNc2c1cc1ccccc1c2

STK755601
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- (morpholin- 4- ylmethyl)- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: NNC(=O)c1nnn(c1CN1CCOCC1)c1nonc1N

STK755603
Synonyms: (3- methyl- 1- phenyl- 1H- thieno[2,3- c]pyrazol- 5- yl)(1H- pyrazol- 1- yl)methanone
Smiles: Cc1nn(c2c1cc(s2)C(=O)n1cccn1)c1ccccc1

STK673172
Synonyms: 4- {(E)- [5- (pyridin- 3- yl)- 1,3,4- thiadiazol- 2- yl]diazenyl}phenol
Smiles: Oc1ccc(cc1)/N=N/c1nnc(s1)c1cccnc1

STK755625
Synonyms: 2- oxo- 2- (phenylamino)ethyl4- amino- 1,2,5- oxadiazole- 3- carboxylate
Smiles: O=C(Nc1ccccc1)COC(=O)c1nonc1N

STK673182
Synonyms: N~2~,N~6~- bis[(benzyloxy)carbonyl]- N- (3,4- dimethylphenyl)lysinamide
Smiles: O=C(OCc1ccccc1)NCCCCC(C(=O)Nc1ccc(c(c1)C)C)NC(=O)OCc1ccccc1

STK755639
Synonyms: N- (tetrahydrofuran- 2- ylmethyl)- 2,1,3- benzothiadiazole- 4- sulfonamide
Smiles: O=S(=O)(c1cccc2c1nsn2)NCC1CCCO1

STK673185
Synonyms: methyl2- {[2- (3,4- dimethoxyphenyl)ethyl]amino}- 3,3,3- trifluoro- N- (phenylcarbonyl)alaninate
Smiles: COC(=O)C(C(F)(F)F)(NC(=O)c1ccccc1)NCCc1ccc(c(c1)OC)OC

STK755642
Synonyms: (2Z)- 2- {(2E)- [1- (4- methyl- 1,2,5- oxadiazol- 3- yl)ethylidene]hydrazinylidene}- 1,3- thiazolidin- 4- one
Smiles: O=C1CS/C(=N\N=C(\c2nonc2C)/C)/N1

STK755643
Synonyms: N'- [(Z)- (2- hydroxynaphthalen- 1- yl)methylidene]- 2- phenylethanesulfonohydrazide
Smiles: Oc1ccc2c(c1/C=N\NS(=O)(=O)CCc1ccccc1)cccc2

STK755647
Synonyms: N- (3,4- dichlorophenyl)- 4- [4- (piperidin- 1- ylsulfonyl)phenyl]- 1,3- thiazol- 2- amine
Smiles: Clc1ccc(cc1Cl)Nc1scc(n1)c1ccc(cc1)S(=O)(=O)N1CCCCC1

STK755648
Synonyms: 1- {(E)- [(5- methoxyquinolin- 8- yl)imino]methyl}naphthalen- 2- ol
Smiles: COc1ccc(c2c1cccn2)/N=C/c1c(O)ccc2c1cccc2

STK673205
Synonyms: 2- amino- 7,7- dimethyl- 5- oxo- 4- (thiophen- 2- yl)- 1- [2- (trifluoromethyl)phenyl]- 1,4,5,6,7,8- hexahydroquinoline- 3- carbonitrile
Smiles: N#CC1=C(N)N(C2=C(C1c1cccs1)C(=O)CC(C2)(C)C)c1ccccc1C(F)(F)F

STK755672
Synonyms: methyl2- (4- methoxyphenyl)imidazo[2,1- b][1,3]benzothiazole- 7- carboxylate
Smiles: COc1ccc(cc1)c1nc2n(c1)c1c(s2)cc(cc1)C(=O)OC

STK673213
Synonyms: 2- [(6- {[(E)- (4- bromophenyl)methylidene]amino}- 1,3- benzothiazol- 2- yl)sulfanyl]- N- (2,4,6- trimethylphenyl)propanamide
Smiles: O=C(C(Sc1nc2c(s1)cc(cc2)/N=C/c1ccc(cc1)Br)C)Nc1c(C)cc(cc1C)C

STK673218
Synonyms: ethyl2- amino- 4- (4- chlorophenyl)- 7,7- dimethyl- 1- (3- nitrophenyl)- 5- oxo- 1,4,5,6,7,8- hexahydroquinoline- 3- carboxylate
Smiles: CCOC(=O)C1=C(N)N(c2cccc(c2)[N+](=O)[O-])C2=C(C1c1ccc(cc1)Cl)C(=O)CC(C2)(C)C

STK755676
Synonyms: 2- [(6- {[(E)- (3,5- dichloro- 2- hydroxyphenyl)methylidene]amino}- 1,3- benzothiazol- 2- yl)sulfanyl]- N- (2,4- dimethylphenyl)acetamide
Smiles: O=C(Nc1ccc(cc1C)C)CSc1sc2c(n1)ccc(c2)/N=C/c1cc(Cl)cc(c1O)Cl

STK755681
Synonyms: 2- [(6- {[(E)- (5- chloro- 2- hydroxyphenyl)methylidene]amino}- 1,3- benzothiazol- 2- yl)sulfanyl]- N- (2,4- dimethylphenyl)acetamide
Smiles: O=C(Nc1ccc(cc1C)C)CSc1sc2c(n1)ccc(c2)/N=C/c1cc(Cl)ccc1O

STK755683
Synonyms: 2- [(6- {[(E)- (3,5- dichloro- 2- hydroxyphenyl)methylidene]amino}- 1,3- benzothiazol- 2- yl)sulfanyl]- N- (2,6- dimethylphenyl)acetamide
Smiles: O=C(Nc1c(C)cccc1C)CSc1sc2c(n1)ccc(c2)/N=C/c1cc(Cl)cc(c1O)Cl

STK755686
Synonyms: N- (3- chloro- 4- methylphenyl)- 4- [4- (morpholin- 4- ylsulfonyl)phenyl]- 1,3- thiazol- 2- amine
Smiles: Cc1ccc(cc1Cl)Nc1scc(n1)c1ccc(cc1)S(=O)(=O)N1CCOCC1

STK755693
Synonyms: 8- chloro- N- (2- nitrophenyl)- 2- phenylquinoline- 4- carboxamide
Smiles: [O-][N+](=O)c1ccccc1NC(=O)c1cc(nc2c1cccc2Cl)c1ccccc1

STK673233
Synonyms: 1,2- bis(propylsulfonyl)- 7- (pyridin- 4- yl)- N'- [(E)- (3,4,5- trimethoxyphenyl)methylidene]indolizine- 3- carbohydrazide
Smiles: CCCS(=O)(=O)c1c(C(=O)N/N=C/c2cc(OC)c(c(c2)OC)OC)n2c(c1S(=O)(=O)CCC)cc(cc2)c1ccncc1

STK673236
Synonyms: 2- [(6- {[(E)- (3,5- dibromo- 2- hydroxyphenyl)methylidene]amino}- 1,3- benzothiazol- 2- yl)sulfanyl]- 1- (morpholin- 4- yl)ethanone
Smiles: Brc1cc(/C=N/c2ccc3c(c2)sc(n3)SCC(=O)N2CCOCC2)c(c(c1)Br)O

STK755712
Synonyms: ethyl1- [(3- bromophenyl)carbonyl]- 3- ethyl- 5- hydroxy- 4,5- dihydro- 1H- pyrazole- 5- carboxylate
Smiles: CCOC(=O)C1(O)CC(=NN1C(=O)c1cccc(c1)Br)CC

STK755718
Synonyms: 5- amino- 3- [(Z)- 2- (4- chlorophenyl)- 1- cyanoethenyl]- 1- (2- hydroxyethyl)- 1H- pyrazole- 4- carbonitrile
Smiles: OCCn1nc(c(c1N)C#N)/C(=C/c1ccc(cc1)Cl)/C#N

STK673243
Synonyms: N'- {(E)- [5- (2,4- dichlorophenyl)furan- 2- yl]methylidene}- 2- (5- phenyl- 2H- tetrazol- 2- yl)acetohydrazide
Smiles: O=C(Cn1nnc(n1)c1ccccc1)N/N=C/c1ccc(o1)c1ccc(cc1Cl)Cl

STK755723
Synonyms: N'- [(E)- {4- [(2,4- dichlorobenzyl)oxy]- 3- methoxyphenyl}methylidene]- 2- (5- phenyl- 2H- tetrazol- 2- yl)acetohydrazide
Smiles: COc1cc(/C=N/NC(=O)Cn2nnc(n2)c2ccccc2)ccc1OCc1ccc(cc1Cl)Cl

STK755725
Synonyms: 4- ({6- [(4- fluorophenyl)amino][1,2,5]oxadiazolo[3,4- b]pyrazin- 5- yl}amino)- 1,5- dimethyl- 2- phenyl- 1,2- dihydro- 3H- pyrazol- 3- one
Smiles: Fc1ccc(cc1)Nc1nc2nonc2nc1Nc1c(C)n(n(c1=O)c1ccccc1)C

STK755730
Synonyms: 5- amino- 3- {(Z)- 1- cyano- 2- [4- (propan- 2- yl)phenyl]ethenyl}- 1- phenyl- 1H- pyrazole- 4- carbonitrile
Smiles: N#C/C(=C\c1ccc(cc1)C(C)C)/c1nn(c(c1C#N)N)c1ccccc1

STK755742
Synonyms: 3- ethyl- 5- (3- methyl- 5- phenyl- 1H- pyrazol- 1- yl)- 4H- 1,2,4- triazol- 4- amine
Smiles: CCc1nnc(n1N)n1nc(cc1c1ccccc1)C

STK673251
Synonyms: 3- [(2E)- 2- (2- chlorobenzylidene)hydrazinyl]- 4H- 1,2,4- triazol- 4- amine
Smiles: Clc1ccccc1/C=N/Nc1nncn1N

STK755760
Synonyms: N'- [(1E,2E)- 3- phenylprop- 2- en- 1- ylidene]- 2- (5- phenyl- 2H- tetrazol- 2- yl)acetohydrazide
Smiles: O=C(Cn1nnc(n1)c1ccccc1)N/N=C/C=C/c1ccccc1

STK755761
Synonyms: N'- [(E)- (3- nitrophenyl)methylidene]- 2- (5- phenyl- 2H- tetrazol- 2- yl)acetohydrazide
Smiles: O=C(Cn1nnc(n1)c1ccccc1)N/N=C/c1cccc(c1)[N+](=O)[O-]

STK673260
Synonyms: 2- [(4- chlorobenzyl)sulfonyl]cyclohexylN,N- dimethyl- beta- alaninate
Smiles: CN(CCC(=O)OC1CCCCC1S(=O)(=O)Cc1ccc(cc1)Cl)C

STK673262
Synonyms: N- {2,2,2- trichloro- 1- [(4- methyl- 2- nitrophenyl)amino]ethyl}acetamide
Smiles: CC(=O)NC(C(Cl)(Cl)Cl)Nc1ccc(cc1[N+](=O)[O-])C

STK755771
Synonyms: 3,3'- [(1E)- 3- (4- nitrobenzyl)triaz- 1- ene- 1,3- diyl]bis(4- methyl- 1,2,5- oxadiazole)
Smiles: Cc1nonc1N(Cc1ccc(cc1)[N+](=O)[O-])/N=N/c1nonc1C

STK755774
Synonyms: 1- [5- hydroxy- 5- (3- methoxyphenyl)- 3- (trifluoromethyl)- 4,5- dihydro- 1H- pyrazol- 1- yl]- 2- methylpropan- 1- one
Smiles: COc1cccc(c1)C1(O)CC(=NN1C(=O)C(C)C)C(F)(F)F

STK755779
Synonyms: ethyl2- [(3,4- dichlorophenyl)amino]- 3,3,3- trifluoro- N- propanoylalaninate
Smiles: CCOC(=O)C(C(F)(F)F)(Nc1ccc(c(c1)Cl)Cl)NC(=O)CC

STK755781
Synonyms: ethyl6- bromo- 5- methoxy- 2- (morpholin- 4- ylmethyl)- 1- phenyl- 1H- indole- 3- carboxylate
Smiles: CCOC(=O)c1c2cc(OC)c(cc2n(c1CN1CCOCC1)c1ccccc1)Br

STK755787
Synonyms: 1- benzyl- 3- phenyl- 1H- pyrazol- 5- amine
Smiles: Nc1cc(nn1Cc1ccccc1)c1ccccc1

STK673271
Synonyms: 4- [(4- methylphenyl)amino]- 3- nitrobenzoicacid
Smiles: Cc1ccc(cc1)Nc1ccc(cc1[N+](=O)[O-])C(=O)O

STK673276
Synonyms: 2- methyl- N- (3- methylphenyl)- 2- (2- oxoazetidin- 1- yl)butanamide
Smiles: CCC(N1CCC1=O)(C(=O)Nc1cccc(c1)C)C

STK673279
Synonyms: 2- [(4- chlorophenyl)amino]- 3,5- dinitrobenzoicacid
Smiles: Clc1ccc(cc1)Nc1c(cc(cc1[N+](=O)[O-])[N+](=O)[O-])C(=O)O

STK755805
Synonyms: N- [(E)- (2- chlorophenyl)methylidene]- 1- [1- (3- methylphenyl)- 1H- tetrazol- 5- yl]cyclohexanamine
Smiles: Cc1cccc(c1)n1nnnc1C1(CCCCC1)/N=C/c1ccccc1Cl

STK755815
Synonyms: N'- [(E)- (3- fluorophenyl)methylidene]- 1,2- bis(propylsulfonyl)indolizine- 3- carbohydrazide
Smiles: CCCS(=O)(=O)c1c(C(=O)N/N=C/c2cccc(c2)F)n2c(c1S(=O)(=O)CCC)cccc2

STK755818
Synonyms: 9,10- dioxo- N- (2- oxo- 2- phenylethyl)- 9,10- dihydroanthracene- 2- sulfonamide
Smiles: O=C(c1ccccc1)CNS(=O)(=O)c1ccc2c(c1)C(=O)c1c(C2=O)cccc1

STK755824
Synonyms: methylN- (phenoxycarbonyl)tryptophylglycinate
Smiles: COC(=O)CNC(=O)C(Cc1c[nH]c2c1cccc2)NC(=O)Oc1ccccc1

STK755827
Synonyms: 3- {[(3,4- dichlorophenyl)amino]methyl}- 5- (4- hydroxyphenyl)- 1,3,4- oxadiazole- 2(3H)- thione
Smiles: Oc1ccc(cc1)c1oc(=S)n(n1)CNc1ccc(c(c1)Cl)Cl

STK755831
Synonyms: ethyl3,5- dimethyl- 4- [(4- methylphenyl)carbonyl]- 1H- pyrrole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c(c(c1C)C(=O)c1ccc(cc1)C)C

STK755840
Synonyms: 4- [(6- methoxy- 2- methylquinolin- 4- yl)amino]benzoicacid
Smiles: COc1ccc2c(c1)c(Nc1ccc(cc1)C(=O)O)cc(n2)C

STK755842
Synonyms: 3- (ethylsulfanyl)- N- [(E)- thiophen- 2- ylmethylidene]- 7H- [1,2,4]triazolo[4,3- b][1,2,4]triazol- 7- amine
Smiles: CCSc1nnc2n1ncn2/N=C/c1cccs1

STK755852
Synonyms: N- (4- chlorophenyl)- 6- methoxy- N'- [2- (morpholin- 4- yl)ethyl]- 1,3,5- triazine- 2,4- diamine
Smiles: COc1nc(NCCN2CCOCC2)nc(n1)Nc1ccc(cc1)Cl

STK755864
Synonyms: ethyl6- bromo- 1- cyclohexyl- 5- hydroxy- 2- (pyrrolidin- 1- ylmethyl)- 1H- indole- 3- carboxylate
Smiles: CCOC(=O)c1c2cc(O)c(cc2n(c1CN1CCCC1)C1CCCCC1)Br

STK673308
Synonyms: 2,2'- {benzene- 1,4- diylbis[(E)methylylidene(2E)hydrazin- 1- yl- 2- ylidene]}bis[4,6- di(morpholin- 4- yl)- 1,3,5- triazine]
Smiles: O1CCN(CC1)c1nc(N/N=C/c2ccc(cc2)/C=N/Nc2nc(nc(n2)N2CCOCC2)N2CCOCC2)nc(n1)N1CCOCC1

STK673312
Synonyms: N- cyclohexyl- 4- [(2E)- 2- (3- methoxy- 4- methylbenzylidene)hydrazinyl]- 4- oxobutanamide
Smiles: COc1cc(/C=N/NC(=O)CCC(=O)NC2CCCCC2)ccc1C

STK755871
Synonyms: N- cyclohexyl- 4- [(2E)- 2- (2,4- dichlorobenzylidene)hydrazinyl]- 4- oxobutanamide
Smiles: O=C(CCC(=O)NC1CCCCC1)N/N=C/c1ccc(cc1Cl)Cl

STK755889
Synonyms: 2- (2- hydroxy- 4,4- dimethyl- 6- oxocyclohex- 1- en- 1- yl)- N- (4- sulfamoylphenyl)acetamide
Smiles: O=C(CC1=C(O)CC(CC1=O)(C)C)Nc1ccc(cc1)S(=O)(=O)N

STK755891
Synonyms: 2- [(2- oxo- 2H- chromen- 7- yl)oxy]- N- (pyridin- 2- yl)acetamide
Smiles: O=C(Nc1ccccn1)COc1ccc2c(c1)oc(=O)cc2

STK755893
Synonyms: 1- cyclopropyl- 2- (4- nitro- 1H- imidazol- 1- yl)ethanone
Smiles: O=C(C1CC1)Cn1cnc(c1)[N+](=O)[O-]

STK755894
Synonyms: 3- (4- methoxyphenyl)- N- (5- methyl- 1,2- oxazol- 3- yl)- 3- [(trifluoroacetyl)amino]propanamide
Smiles: COc1ccc(cc1)C(NC(=O)C(F)(F)F)CC(=O)Nc1noc(c1)C

STK755900
Synonyms: (5E)- 2- (2- chloro- 5- iodophenyl)- 5- (thiophen- 2- ylmethylidene)- 3,5- dihydro- 4H- imidazol- 4- one
Smiles: Ic1ccc(c(c1)C1=N/C(=C/c2cccs2)/C(=O)N1)Cl

STK755922
Synonyms: (3E)- 3- (2- {[4- (acetylamino)phenyl]carbonyl}hydrazinylidene)- N- cyclopentylbutanamide
Smiles: O=C(c1ccc(cc1)NC(=O)C)N/N=C(/CC(=O)NC1CCCC1)\C

STK673339
Synonyms: 4- (2,5- dimethylphenyl)- N- (3,5- dimethylphenyl)- 1,3- thiazol- 2- amine
Smiles: Cc1cc(C)cc(c1)Nc1scc(n1)c1cc(C)ccc1C

STK755944
Synonyms: 2- {[(E)- (7- methoxy- 1,3- benzodioxol- 5- yl)methylidene]amino}- 4,5,6,7- tetrahydro- 1- benzothiophene- 3- carbonitrile
Smiles: N#Cc1c(/N=C/c2cc(OC)c3c(c2)OCO3)sc2c1CCCC2

STK755946
Synonyms: 4- [1- (1H- tetrazol- 5- ylmethyl)- 1H- benzimidazol- 2- yl]- 1,2,5- oxadiazol- 3- amine
Smiles: Nc1nonc1c1nc2c(n1Cc1nnn[nH]1)cccc2

STK755951
Synonyms: (2,4- dichlorophenyl)[1- (4- ethoxyphenyl)- 1,3,4,9- tetrahydro- 2H- beta- carbolin- 2- yl]methanone
Smiles: CCOc1ccc(cc1)C1N(CCc2c1[nH]c1c2cccc1)C(=O)c1ccc(cc1Cl)Cl

STK755957
Synonyms: pyridin- 3- yl[(6- methyl- 5- oxo- 4,5- dihydro- 1,2,4- triazin- 3- yl)sulfanyl]acetate
Smiles: O=C(Oc1cccnc1)CSc1nnc(c(=O)[nH]1)C

STK755958
Synonyms: ethyl2- oxo- 5- [(pyridin- 2- ylsulfanyl)methyl]- 2,3- dihydro- 1H- imidazole- 4- carboxylate
Smiles: CCOC(=O)c1[nH]c(=O)[nH]c1CSc1ccccn1

STK673345
Synonyms: benzyl1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- methyl- 1H- 1,2,3- triazole- 4- carboxylate
Smiles: O=C(c1nnn(c1C)c1nonc1N)OCc1ccccc1

STK673347
Synonyms: (2,6- difluorophenyl)({[(1E)- 1- (2,4- difluorophenyl)ethylidene]amino}oxy)methanone
Smiles: Fc1ccc(c(c1)F)/C(=N/OC(=O)c1c(F)cccc1F)/C

STK755972
Synonyms: (2- fluorophenyl)[({(1E)- 1- [3- fluoro- 4- (piperidin- 1- yl)phenyl]ethylidene}amino)oxy]methanone
Smiles: C/C(=N\OC(=O)c1ccccc1F)/c1ccc(c(c1)F)N1CCCCC1

STK755975
Synonyms: N- [(1Z)- 3- [benzyl(methyl)amino]- 1- (4- fluorophenyl)- 3- oxoprop- 1- en- 2- yl]benzamide
Smiles: Fc1ccc(cc1)/C=C(/C(=O)N(Cc1ccccc1)C)\NC(=O)c1ccccc1

STK755977
Synonyms: N- (2- {[2- (benzylamino)- 2- oxoethyl]sulfanyl}- 1,3- benzothiazol- 6- yl)- 2,4- dichlorobenzamide
Smiles: O=C(NCc1ccccc1)CSc1nc2c(s1)cc(cc2)NC(=O)c1ccc(cc1Cl)Cl

STK755982
Synonyms: 4- chloro- 2- [(E)- {[2- (4- chlorophenoxy)- 5- (trifluoromethyl)phenyl]imino}methyl]phenol
Smiles: Clc1ccc(cc1)Oc1ccc(cc1/N=C/c1cc(Cl)ccc1O)C(F)(F)F

STK673359
Synonyms: N- [3- (methylsulfonyl)- 1H- 1,2,4- triazol- 5- yl]acetamide
Smiles: CC(=O)Nc1[nH]nc(n1)S(=O)(=O)C

STK755990
Synonyms: 2- (3,4- dimethylphenyl)- 5- [(4- methylpiperidin- 1- yl)carbonyl]- 1H- isoindole- 1,3(2H)- dione
Smiles: CC1CCN(CC1)C(=O)c1ccc2c(c1)C(=O)N(C2=O)c1ccc(c(c1)C)C

STK755991
Synonyms: prop- 2- yn- 1- yl(2Z)- 2- (acetylamino)- 3- (4- fluorophenyl)prop- 2- enoate
Smiles: C#CCOC(=O)/C(=C/c1ccc(cc1)F)/NC(=O)C

STK755992
Synonyms: prop- 2- yn- 1- yl(2Z)- 3- (4- fluorophenyl)- 2- [(phenylcarbonyl)amino]prop- 2- enoate
Smiles: C#CCOC(=O)/C(=C/c1ccc(cc1)F)/NC(=O)c1ccccc1

STK673369
Synonyms: 1a',2',2a',5a',6',6a'- hexahydro- 1'H- dispiro[cyclopropane- 1,3'- [2,6]methanocyclopropa[f]indene- 7',1''- cyclopropane]
Smiles: C1C2C1C1C3(C2C2C1C1(C=C2)CC1)CC3

STK755998
Synonyms: 4- {2- [(pentafluorophenyl)sulfanyl]ethyl}pyridine
Smiles: Fc1c(SCCc2ccncc2)c(F)c(c(c1F)F)F

STK673373
Synonyms: 2- methyl- 3- oxobutan- 2- yl1,3- thiazol- 2- ylcarbamate
Smiles: O=C(OC(C(=O)C)(C)C)Nc1nccs1

STK673374
Synonyms: 2- methyl- 3- oxobutan- 2- yl1,3- benzothiazol- 2- ylcarbamate
Smiles: O=C(OC(C(=O)C)(C)C)Nc1nc2c(s1)cccc2

STK673377
Synonyms: N- (dibenzo[b,d]furan- 3- yl)- 2- [(6- {[(Z)- (2- hydroxynaphthalen- 1- yl)methylidene]amino}- 1,3- benzothiazol- 2- yl)sulfanyl]acetamide
Smiles: O=C(Nc1ccc2c(c1)oc1c2cccc1)CSc1nc2c(s1)cc(cc2)/N=C\c1c(O)ccc2c1cccc2

STK756007
Synonyms: N- benzyl- Nalpha- (phenoxycarbonyl)tryptophanamide
Smiles: O=C(NC(C(=O)NCc1ccccc1)Cc1c[nH]c2c1cccc2)Oc1ccccc1

STK756012
Synonyms: 6- methoxy- 3- {2- [(4- methoxyphenyl)amino]- 1,3- thiazol- 4- yl}- 2H- chromen- 2- one
Smiles: COc1ccc(cc1)Nc1scc(n1)c1cc2cc(OC)ccc2oc1=O

STK756016
Synonyms: 2- (1,3- dioxo- 1,3- dihydro- 2H- isoindol- 2- yl)- 4,5- dimethylthiophene- 3- carbonitrile
Smiles: N#Cc1c(sc(c1C)C)N1C(=O)c2c(C1=O)cccc2

STK756017
Synonyms: 4- chloro- N- (3- hydroxypyridin- 2- yl)benzenesulfonamide
Smiles: Clc1ccc(cc1)S(=O)(=O)Nc1ncccc1O

STK756021
Synonyms: ethyl2- [(3- chloro- 4- fluorophenyl)amino]- 3,3,3- trifluoro- N- (phenylcarbonyl)alaninate
Smiles: CCOC(=O)C(C(F)(F)F)(NC(=O)c1ccccc1)Nc1ccc(c(c1)Cl)F

STK756028
Synonyms: N- [1- (3- chlorobenzyl)- 3- phenyl- 1H- pyrazol- 5- yl]acetamide
Smiles: CC(=O)Nc1cc(nn1Cc1cccc(c1)Cl)c1ccccc1

STK756029
Synonyms: 5H- [1,2,5]oxadiazolo[3',4':5,6]pyrazino[2,3- b]indole
Smiles: c1ccc2c(c1)[nH]c1c2nc2c(n1)non2

STK673389
Synonyms: 2- [(4,6- dioxo- 1,4,5,6- tetrahydropyrimidin- 2- yl)sulfanyl]- N- (2- nitrophenyl)acetamide
Smiles: O=C1NC(=NC(=O)C1)SCC(=O)Nc1ccccc1[N+](=O)[O-]

STK673390
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- (piperidin- 1- ylmethyl)- N'- [(E)- pyridin- 4- ylmethylidene]- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: O=C(c1nnn(c1CN1CCCCC1)c1nonc1N)N/N=C/c1ccncc1

STK756034
Synonyms: (2S,3S,10bR)- 2- phenyl- 3- (phenylcarbonyl)- 2,3- dihydropyrrolo[2,1- a]isoquinoline- 1,1(10bH)- dicarbonitrile
Smiles: N#CC1(C#N)[C@H](c2ccccc2)[C@H](N2[C@@H]1c1ccccc1C=C2)C(=O)c1ccccc1

STK756035
Synonyms: (3R,4R)- 6- amino- 4- (4- bromophenyl)- 5- cyano- 2- thioxo- 1,2,3,4- tetrahydropyridine- 3- carboxamide
Smiles: N#CC1=C(N)NC(=S)[C@H]([C@@H]1c1ccc(cc1)Br)C(=O)N

STK756039
Synonyms: 5- [(2E)- 2- (3- methoxybenzylidene)hydrazinyl]- 3- (methylsulfanyl)- 1,2- thiazole- 4- carbonitrile
Smiles: N#Cc1c(N/N=C/c2cccc(c2)OC)snc1SC

STK673395
Synonyms: N~2~- (2,4- dimethoxyphenyl)- N~4~,N~6~- bis(pyridin- 3- ylmethyl)- 1,3,5- triazine- 2,4,6- triamine
Smiles: COc1cc(OC)ccc1Nc1nc(NCc2cccnc2)nc(n1)NCc1cccnc1

STK673396
Synonyms: [1- (2- {[5- (butylsulfanyl)- 1,3,4- thiadiazol- 2- yl]amino}- 2- oxoethyl)- 1H- 1,2,4- triazol- 4- ium- 4- yl](nitro)azanide
Smiles: [O-][N+](=O)[N-][n+]1cn(nc1)CC(=O)Nc1nnc(s1)SCCCC

STK673397
Synonyms: 2- (morpholin- 4- yl)- 2- oxoethyl({2- [(5- bromopyridin- 2- yl)amino]- 2- oxoethyl}sulfanyl)acetate
Smiles: O=C(Nc1ccc(cn1)Br)CSCC(=O)OCC(=O)N1CCOCC1

STK756051
Synonyms: 2- (3- chlorophenyl)- 3- (trifluoromethyl)quinoxaline
Smiles: Clc1cccc(c1)c1nc2ccccc2nc1C(F)(F)F

STK756056
Synonyms: 2- [(E)- {[2- (4- chlorophenoxy)- 5- (trifluoromethyl)phenyl]imino}methyl]phenol
Smiles: Clc1ccc(cc1)Oc1ccc(cc1/N=C/c1ccccc1O)C(F)(F)F

STK756058
Synonyms: 2- chloro- 6- [(E)- {[2- (4- chlorophenoxy)- 5- (trifluoromethyl)phenyl]imino}methyl]phenol
Smiles: Clc1ccc(cc1)Oc1ccc(cc1/N=C/c1cccc(c1O)Cl)C(F)(F)F

STK756074
Synonyms: 2- (6- methylpyridin- 2- yl)- 1H- isoindole- 1,3(2H)- dione
Smiles: Cc1cccc(n1)N1C(=O)c2c(C1=O)cccc2

STK756076
Synonyms: N- {(2E)- 2- [(phenylcarbonyl)amino]- 3- [4- (propan- 2- yloxy)phenyl]prop- 2- enoyl}- beta- alanine
Smiles: OC(=O)CCNC(=O)/C(=C\c1ccc(cc1)OC(C)C)/NC(=O)c1ccccc1

STK756079
Synonyms: N,N'- bis[2- (2- oxo- 1,3- oxazolidin- 3- yl)ethyl]ethanediamide
Smiles: O=C(C(=O)NCCN1CCOC1=O)NCCN1CCOC1=O

STK756088
Synonyms: 5- amino- 3- [(Z)- 1- cyano- 2- (2,3- dimethoxyphenyl)ethenyl]- 1- (2- hydroxyethyl)- 1H- pyrazole- 4- carbonitrile
Smiles: OCCn1nc(c(c1N)C#N)/C(=C/c1cccc(c1OC)OC)/C#N

STK673421
Synonyms: methyl[5- (1,1,1,3,3,3- hexafluoro- 2- hydroxypropan- 2- yl)- 3- hydroxy- 2- oxo- 3- (trifluoromethyl)- 2,3- dihydro- 1H- indol- 1- yl]acetate
Smiles: COC(=O)CN1c2ccc(cc2C(C1=O)(O)C(F)(F)F)C(C(F)(F)F)(C(F)(F)F)O

STK756110
Synonyms: N'- [(E)- {2- [(3- methoxybenzyl)oxy]phenyl}methylidene]- 2- (3- methylphenoxy)acetohydrazide
Smiles: COc1cccc(c1)COc1ccccc1/C=N/NC(=O)COc1cccc(c1)C

STK756113
Synonyms: (1E)- 1- (2,4- dichlorobenzylidene)- 2- [2,3,5,6- tetrafluoro- 4- (trifluoromethyl)phenyl]hydrazine
Smiles: Clc1ccc(c(c1)Cl)/C=N/Nc1c(F)c(F)c(c(c1F)F)C(F)(F)F

STK756125
Synonyms: ethyl3,3,3- trifluoro- 2- {4- [(furan- 2- ylcarbonyl)amino]- 3- methoxyphenyl}- 2- hydroxypropanoate
Smiles: CCOC(=O)C(C(F)(F)F)(c1ccc(c(c1)OC)NC(=O)c1ccco1)O

STK756134
Synonyms: methyl5- (2- cyanophenoxy)- 4- oxopentanoate
Smiles: COC(=O)CCC(=O)COc1ccccc1C#N

STK756136
Synonyms: ethyl1- methyl- 5- {[(4- methylphenyl)sulfonyl]oxy}- 2- (morpholin- 4- ylmethyl)- 1H- indole- 3- carboxylate
Smiles: CCOC(=O)c1c(CN2CCOCC2)n(c2c1cc(cc2)OS(=O)(=O)c1ccc(cc1)C)C

STK756138
Synonyms: 4- bromo- 3- (diethylsulfamoyl)- N- (pyridin- 2- yl)benzamide
Smiles: CCN(S(=O)(=O)c1cc(ccc1Br)C(=O)Nc1ccccn1)CC

STK673444
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- (azepan- 1- ylmethyl)- N'- [(E)- (3- chlorophenyl)methylidene]- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: Clc1cccc(c1)/C=N/NC(=O)c1nnn(c1CN1CCCCCC1)c1nonc1N

STK673445
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- (azepan- 1- ylmethyl)- N'- [(E)- (5- chloro- 2- hydroxyphenyl)methylidene]- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: Clc1ccc(c(c1)/C=N/NC(=O)c1nnn(c1CN1CCCCCC1)c1nonc1N)O

STK673449
Synonyms: ethyl2- amino- 4- (3- hydroxy- 4- methoxyphenyl)- 5- oxo- 1- [3- (trifluoromethyl)phenyl]- 1,4,5,6,7,8- hexahydroquinoline- 3- carboxylate
Smiles: CCOC(=O)C1=C(N)N(c2cccc(c2)C(F)(F)F)C2=C(C1c1ccc(c(c1)O)OC)C(=O)CCC2

STK756148
Synonyms: 2- {[3- (butylsulfanyl)- 2- hydroxypropyl]sulfanyl}- 4- (4- methylphenyl)- 6- phenylpyridine- 3- carbonitrile
Smiles: CCCCSCC(CSc1nc(cc(c1C#N)c1ccc(cc1)C)c1ccccc1)O

STK756153
Synonyms: 1- benzyl- 3,4- diphenyl- 1H- pyrazol- 5- amine
Smiles: Nc1n(Cc2ccccc2)nc(c1c1ccccc1)c1ccccc1

STK673450
Synonyms: 5- cyclohexyl- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: S=c1[nH]nc([nH]1)C1CCCCC1

STK756155
Synonyms: 2'- benzyl- 1,3- dihydro- 1'H- 2,5'- biisoindole- 1',3'(2'H)- dione
Smiles: O=C1c2cc(ccc2C(=O)N1Cc1ccccc1)N1Cc2c(C1)cccc2

STK673454
Synonyms: 3- methyl- 5- (2- oxopropyl)- 1- phenyl- 1H- pyrazole- 4- carboxylicacid
Smiles: CC(=O)Cc1n(nc(c1C(=O)O)C)c1ccccc1

STK673455
Synonyms: 2- amino- 5- oxo- 4- (thiophen- 3- yl)- 1- [2- (trifluoromethyl)phenyl]- 1,4,5,6,7,8- hexahydroquinoline- 3- carbonitrile
Smiles: N#CC1=C(N)N(C2=C(C1c1ccsc1)C(=O)CCC2)c1ccccc1C(F)(F)F

STK673457
Synonyms: 1- (4- methoxyphenyl)- 2,5- dioxopyrrolidin- 3- yl(2E)- 2- {(3E)- 4- [4- (dimethylamino)phenyl]but- 3- en- 2- ylidene}hydrazinecarbimidothioate
Smiles: COc1ccc(cc1)N1C(=O)CC(C1=O)SC(=N)N/N=C(/C=C/c1ccc(cc1)N(C)C)\C

STK673458
Synonyms: 2- hydroxy- 5- [(6- methoxy- 2- methylquinolin- 4- yl)amino]benzoicacid
Smiles: COc1ccc2c(c1)c(Nc1ccc(c(c1)C(=O)O)O)cc(n2)C

STK756174
Synonyms: [5- hydroxy- 5- (3- methoxyphenyl)- 3- (trifluoromethyl)- 4,5- dihydro- 1H- pyrazol- 1- yl](2- hydroxyphenyl)methanone
Smiles: COc1cccc(c1)C1(O)CC(=NN1C(=O)c1ccccc1O)C(F)(F)F

STK756180
Synonyms: 6- (4- benzylpiperidin- 1- yl)- N- (2,3- dimethylphenyl)[1,2,5]oxadiazolo[3,4- b]pyrazin- 5- amine
Smiles: Cc1c(cccc1C)Nc1nc2nonc2nc1N1CCC(CC1)Cc1ccccc1

STK756182
Synonyms: 2,2- dimethyl- 5- {[5- (2- methyl- 5- nitrophenyl)furan- 2- yl]methylidene}- 1,3- dioxane- 4,6- dione
Smiles: O=C1OC(C)(C)OC(=O)C1=Cc1ccc(o1)c1cc(ccc1C)[N+](=O)[O-]

STK756189
Synonyms: N- (2,3- dimethylphenyl)- 6- (4- methylpiperidin- 1- yl)[1,2,5]oxadiazolo[3,4- b]pyrazin- 5- amine
Smiles: CC1CCN(CC1)c1nc2nonc2nc1Nc1cccc(c1C)C

STK756193
Synonyms: ethyl2- amino- 5- oxo- 1- phenyl- 4- (pyridin- 3- yl)- 1,4,5,6,7,8- hexahydroquinoline- 3- carboxylate
Smiles: CCOC(=O)C1=C(N)N(c2ccccc2)C2=C(C1c1cccnc1)C(=O)CCC2

STK756194
Synonyms: 3- methyl- 5- [(2E)- 2- (thiophen- 2- ylmethylidene)hydrazinyl]- 4H- 1,2,4- triazol- 4- amine
Smiles: Nn1c(N/N=C/c2cccs2)nnc1C

STK756195
Synonyms: 2- amino- 5- phenyl[1,2,4]triazolo[1,5- a]pyrimidin- 7(3H)- one
Smiles: Nc1nn2c([nH]1)nc(cc2=O)c1ccccc1

STK756199
Synonyms: 5- amino- 3- [(Z)- 1- cyano- 2- (2,3- dichlorophenyl)ethenyl]- 1- (2- hydroxyethyl)- 1H- pyrazole- 4- carbonitrile
Smiles: OCCn1nc(c(c1N)C#N)/C(=C/c1cccc(c1Cl)Cl)/C#N

STK673475
Synonyms: 4- {(E)- [(3- cyano- 4,5,6,7- tetrahydro- 1- benzothiophen- 2- yl)imino]methyl}- 2- methoxyphenyl2- chloro- 4,5- difluorobenzoate
Smiles: COc1cc(ccc1OC(=O)c1cc(F)c(cc1Cl)F)/C=N/c1sc2c(c1C#N)CCCC2

STK673476
Synonyms: 3- {5- [(E)- (6,7- dimethyl- 3- oxo[1,3]thiazolo[3,2- a]benzimidazol- 2(3H)- ylidene)methyl]furan- 2- yl}benzoicacid
Smiles: OC(=O)c1cccc(c1)c1ccc(o1)/C=c\1/sc2n(c1=O)c1c(n2)cc(c(c1)C)C

STK673488
Synonyms: 5- amino- 3- [(Z)- 2- {2- bromo- 4- [(2,4- dichlorobenzyl)oxy]- 5- methoxyphenyl}- 1- cyanoethenyl]- 1- phenyl- 1H- pyrazole- 4- carbonitrile
Smiles: N#C/C(=C\c1cc(OC)c(cc1Br)OCc1ccc(cc1Cl)Cl)/c1nn(c(c1C#N)N)c1ccccc1

STK673490
Synonyms: N'- {(E)- [3- iodo- 5- methoxy- 4- (prop- 2- yn- 1- yloxy)phenyl]methylidene}- 2- (5- phenyl- 2H- tetrazol- 2- yl)acetohydrazide
Smiles: C#CCOc1c(I)cc(cc1OC)/C=N/NC(=O)Cn1nnc(n1)c1ccccc1

STK756216
Synonyms: (2E)- 2- (3- ethoxy- 4- hydroxy- 5- iodobenzylidene)- 1- benzothiophen- 3(2H)- one
Smiles: CCOc1cc(cc(c1O)I)/C=C\1/Sc2c(C1=O)cccc2

STK673491
Synonyms: 5- amino- 3- {(Z)- 1- cyano- 2- [3- iodo- 5- methoxy- 4- (prop- 2- yn- 1- yloxy)phenyl]ethenyl}- 1- phenyl- 1H- pyrazole- 4- carbonitrile
Smiles: C#CCOc1c(I)cc(cc1OC)/C=C(/c1nn(c(c1C#N)N)c1ccccc1)\C#N

STK756230
Synonyms: 4- [1- (prop- 2- en- 1- yl)- 1H- benzimidazol- 2- yl]- 1,2,5- oxadiazol- 3- amine
Smiles: C=CCn1c(nc2c1cccc2)c1nonc1N

STK673505
Synonyms: N'- [(E)- 1H- indol- 3- ylmethylidene]decane- 1- sulfonohydrazide
Smiles: CCCCCCCCCCS(=O)(=O)N/N=C/c1c[nH]c2c1cccc2

STK756236
Synonyms: 2- {(Z)- [2- (4- tert- butylphenyl)- 5- oxo- 1,3- oxazol- 4(5H)- ylidene]methyl}phenylbenzenesulfonate
Smiles: O=C1OC(=N/C/1=C\c1ccccc1OS(=O)(=O)c1ccccc1)c1ccc(cc1)C(C)(C)C

STK756237
Synonyms: N'- [(1E)- 1- (3- iodophenyl)ethylidene]- 2- (2- methyl- 1,3- dioxolan- 2- yl)acetohydrazide
Smiles: O=C(CC1(C)OCCO1)N/N=C(/c1cccc(c1)I)\C

STK756241
Synonyms: 2- {[(E)- (4- methoxyphenyl)methylidene]amino}- 3a,4,7,7a- tetrahydro- 1H- spiro[2- aza- 4,7- methanoisoindole- 8,1'- cyclopropane]- 1,3(2H)- dione
Smiles: COc1ccc(cc1)/C=N/N1C(=O)C2C(C1=O)C1C3(C2C=C1)CC3

STK756242
Synonyms: 2- {[(E)- {3- ethoxy- 4- [(4- nitrobenzyl)oxy]phenyl}methylidene]amino}- 3a,4,7,7a- tetrahydro- 1H- spiro[2- aza- 4,7- methanoisoindole- 8,1'- cyclopropane]- 1,3(2H)- dione
Smiles: CCOc1cc(/C=N/N2C(=O)C3C(C2=O)C2C4(C3C=C2)CC4)ccc1OCc1ccc(cc1)[N+](=O)[O-]

STK673511
Synonyms: 4- (3- acetyl- 4- hydroxy- 5- oxo- 2- phenyl- 2,5- dihydro- 1H- pyrrol- 1- yl)- 2- hydroxybenzoicacid
Smiles: CC(=O)C1=C(O)C(=O)N(C1c1ccccc1)c1ccc(c(c1)O)C(=O)O

STK673513
Synonyms: N- [5- (phenylamino)- 1H- tetrazol- 1- yl]tricyclo[3.3.1.1~3,7~]decane- 1- carboxamide
Smiles: O=C(C12CC3CC(C2)CC(C1)C3)Nn1nnnc1Nc1ccccc1

STK756247
Synonyms: N'- [(2E)- 4- methylpent- 3- en- 2- ylidene]benzohydrazide
Smiles: O=C(c1ccccc1)N/N=C(/C=C(C)C)\C

STK756252
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 4- methyl- N'- [(2E)- 1- (5- nitro- 2H- tetrazol- 2- yl)propan- 2- ylidene]- 1H- 1,2,3- triazole- 5- carbohydrazide
Smiles: C/C(=N\NC(=O)c1c(C)nnn1c1nonc1N)/Cn1nnc(n1)[N+](=O)[O-]

STK756265
Synonyms: 1,2,4- trifluoro- 3- (piperidin- 1- yl)dibenzo[b,f][1,4]oxazepine
Smiles: Fc1c2C=Nc3c(Oc2c(c(c1F)N1CCCCC1)F)cccc3

STK673525
Synonyms: 2,2- dichloro- N- (2- methylphenyl)- 1- phenylcyclopropanecarboxamide
Smiles: Cc1ccccc1NC(=O)C1(CC1(Cl)Cl)c1ccccc1

STK756267
Synonyms: 2- (3- {2- [(4- chlorophenyl)amino]- 1,3- thiazol- 4- yl}phenyl)- 1H- isoindole- 1,3(2H)- dione
Smiles: Clc1ccc(cc1)Nc1scc(n1)c1cccc(c1)N1C(=O)c2c(C1=O)cccc2

STK756269
Synonyms: (4E)- 4- [4- (dimethylamino)benzylidene]- 2- (furan- 2- yl)- 1,3- oxazol- 5(4H)- one
Smiles: O=C1OC(=N/C/1=C/c1ccc(cc1)N(C)C)c1ccco1

STK673528
Synonyms: 5,5'- ethane- 1,2- diylbis(1,3,4- thiadiazol- 2- amine)
Smiles: Nc1nnc(s1)CCc1nnc(s1)N

STK756270
Synonyms: N- (furan- 2- ylmethyl)- 3- (morpholin- 4- ylsulfonyl)benzamide
Smiles: O=C(c1cccc(c1)S(=O)(=O)N1CCOCC1)NCc1ccco1

STK756277
Synonyms: N- [2- (1H- indol- 3- yl)ethyl]cyclohexanecarboxamide
Smiles: O=C(C1CCCCC1)NCCc1c[nH]c2c1cccc2

STK756282
Synonyms: [5- hydroxy- 5- (pyridin- 4- yl)- 3- (trifluoromethyl)- 4,5- dihydro- 1H- pyrazol- 1- yl](3- nitrophenyl)methanone
Smiles: O=C(N1N=C(CC1(O)c1ccncc1)C(F)(F)F)c1cccc(c1)[N+](=O)[O-]

STK756295
Synonyms: 2- [(6- {[(E)- (5- bromo- 2- hydroxyphenyl)methylidene]amino}- 1,3- benzothiazol- 2- yl)sulfanyl]- N- butylacetamide
Smiles: CCCCNC(=O)CSc1nc2c(s1)cc(cc2)/N=C/c1cc(Br)ccc1O

STK756299
Synonyms: 2- [(6- {[(E)- (2- chloro- 6- fluorophenyl)methylidene]amino}- 1,3- benzothiazol- 2- yl)sulfanyl]- N- cyclohexylacetamide
Smiles: O=C(NC1CCCCC1)CSc1sc2c(n1)ccc(c2)/N=C/c1c(F)cccc1Cl

STK673543
Synonyms: 5- [(4- iodobenzyl)sulfanyl]- 2- phenyl- 2H- tetrazole
Smiles: Ic1ccc(cc1)CSc1nnn(n1)c1ccccc1

STK756305
Synonyms: ethyl2- amino- 4- (1,3- benzodioxol- 5- yl)- 7,7- dimethyl- 1- (3- nitrophenyl)- 5- oxo- 1,4,5,6,7,8- hexahydroquinoline- 3- carboxylate
Smiles: CCOC(=O)C1=C(N)N(c2cccc(c2)[N+](=O)[O-])C2=C(C1c1ccc3c(c1)OCO3)C(=O)CC(C2)(C)C

STK756311
Synonyms: ethyl5- [(acetyloxy)methyl]- 4- ethyl- 3- methyl- 1H- pyrrole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c(c(c1C)CC)COC(=O)C

STK673547
Synonyms: 7- [(Z)- [(2E)- (4- methylbenzylidene)hydrazinylidene](3- nitrophenyl)methyl]- 1,3,5- triazatricyclo[3.3.1.1~3,7~]decane
Smiles: Cc1ccc(cc1)/C=N/N=C(\C12CN3CN(C2)CN(C1)C3)/c1cccc(c1)[N+](=O)[O-]

STK673549
Synonyms: 3- [4- (2- methylpropyl)phenyl]- 5,6- dihydroimidazo[2,1- b][1,3]thiazole
Smiles: CC(Cc1ccc(cc1)c1csc2=NCCn12)C

STK756319
Synonyms: N- (4- chlorophenyl)- 4- (morpholin- 4- ylsulfonyl)thiophene- 2- carboxamide
Smiles: O=C(c1scc(c1)S(=O)(=O)N1CCOCC1)Nc1ccc(cc1)Cl

STK756323
Synonyms: N- (3- methylphenyl)- 5- (phenylcarbonyl)furan- 2- carboxamide
Smiles: Cc1cccc(c1)NC(=O)c1ccc(o1)C(=O)c1ccccc1

STK756324
Synonyms: 10,10- dichloro- N- (3- methylphenyl)tricyclo[7.1.0.0~4,6~]decane- 5- carboxamide
Smiles: O=C(C1C2C1CCC1C(CC2)C1(Cl)Cl)Nc1cccc(c1)C

STK756331
Synonyms: 2,6- diamino- 4- (5- nitrothiophen- 2- yl)- 4H- thiopyran- 3,5- dicarbonitrile
Smiles: N#CC1=C(N)SC(=C(C1c1ccc(s1)[N+](=O)[O-])C#N)N

STK673565
Synonyms: 2- (3,4- dimethylphenyl)- 5- [(4- phenylpiperazin- 1- yl)carbonyl]- 1H- isoindole- 1,3(2H)- dione
Smiles: O=C(c1ccc2c(c1)C(=O)N(C2=O)c1ccc(c(c1)C)C)N1CCN(CC1)c1ccccc1

STK673567
Synonyms: 4- [3- ({[(2E)- 2- {(3E)- 4- [4- (dimethylamino)phenyl]but- 3- en- 2- ylidene}hydrazinyl](imino)methyl}sulfanyl)- 2,5- dioxopyrrolidin- 1- yl]benzoicacid
Smiles: N=C(SC1CC(=O)N(C1=O)c1ccc(cc1)C(=O)O)N/N=C(/C=C/c1ccc(cc1)N(C)C)\C

STK756338
Synonyms: 3- amino- 6- (methoxymethyl)- 4- methylthieno[2,3- b]pyridine- 2- carboxamide
Smiles: COCc1cc(C)c2c(n1)sc(c2N)C(=O)N

STK756341
Synonyms: (2- methylphenyl)(1,3,4,9- tetrahydro- 2H- beta- carbolin- 2- yl)methanone
Smiles: Cc1ccccc1C(=O)N1CCc2c(C1)[nH]c1c2cccc1

STK756343
Synonyms: N- (1,3- benzothiazol- 2- yl)- 5- (phenylcarbonyl)furan- 2- carboxamide
Smiles: O=C(c1ccc(o1)C(=O)c1ccccc1)Nc1nc2c(s1)cccc2

STK756350
Synonyms: 4,4'- (hydroxycarbonimidoyl)bis(N,N- dimethylaniline)
Smiles: O/N=C(/c1ccc(cc1)N(C)C)\c1ccc(cc1)N(C)C

STK756367
Synonyms: 2,2- dichloro- N- (4- iodophenyl)- 1- phenylcyclopropanecarboxamide
Smiles: Ic1ccc(cc1)NC(=O)C1(CC1(Cl)Cl)c1ccccc1

STK756368
Synonyms: (3Z)- 3- [(4- bromophenyl)imino]- 7- methyl- 1,3- dihydro- 2H- indol- 2- one
Smiles: Brc1ccc(cc1)/N=C/1\C(=O)Nc2c1cccc2C

STK756369
Synonyms: (3Z)- 7- chloro- 3- [(2- chlorophenyl)imino]- 1,3- dihydro- 2H- indol- 2- one
Smiles: O=C1Nc2c(/C/1=N/c1ccccc1Cl)cccc2Cl

STK756374
Synonyms: N- (4- chlorophenyl)- 2,3- diphenylcycloprop- 2- ene- 1- carboxamide
Smiles: O=C(C1C(=C1c1ccccc1)c1ccccc1)Nc1ccc(cc1)Cl

STK756375
Synonyms: methyl2- amino- 7,7- dimethyl- 5- oxo- 4- (pyridin- 3- yl)- 1- [2- (trifluoromethyl)phenyl]- 1,4,5,6,7,8- hexahydroquinoline- 3- carboxylate
Smiles: COC(=O)C1=C(N)N(C2=C(C1c1cccnc1)C(=O)CC(C2)(C)C)c1ccccc1C(F)(F)F

STK756382
Synonyms: 4- amino- N'- [(E)- {5- bromo- 2- [(2,4- dichlorobenzyl)oxy]phenyl}methylidene]- 1,2,5- oxadiazole- 3- carbohydrazide
Smiles: Brc1ccc(c(c1)/C=N/NC(=O)c1nonc1N)OCc1ccc(cc1Cl)Cl

STK673595
Synonyms: N'- {(E)- [3,5- dibromo- 2- (prop- 2- en- 1- yloxy)phenyl]methylidene}- 2- (5- phenyl- 2H- tetrazol- 2- yl)acetohydrazide
Smiles: C=CCOc1c(/C=N/NC(=O)Cn2nnc(n2)c2ccccc2)cc(cc1Br)Br

STK756400
Synonyms: methyl2- amino- 4- (4- methoxyphenyl)- 5- oxo- 1- (4- sulfamoylphenyl)- 1,4,5,6,7,8- hexahydroquinoline- 3- carboxylate
Smiles: COc1ccc(cc1)C1C(=C(N)N(C2=C1C(=O)CCC2)c1ccc(cc1)S(=O)(=O)N)C(=O)OC

STK756403
Synonyms: ethyl1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- [(pyridin- 2- ylsulfanyl)methyl]- 1H- 1,2,3- triazole- 4- carboxylate
Smiles: CCOC(=O)c1nnn(c1CSc1ccccn1)c1nonc1N

STK673600
Synonyms: 2,4- dibromo- 6- [(E)- (4,5,6,7- tetrahydro- 1,3- benzothiazol- 2- ylimino)methyl]phenol
Smiles: Brc1cc(/C=N/c2nc3c(s2)CCCC3)c(c(c1)Br)O

STK673601
Synonyms: ethyl2- ({N- [(4- chlorophenyl)sulfonyl]glycyl}amino)- 4,5- dimethylthiophene- 3- carboxylate
Smiles: CCOC(=O)c1c(NC(=O)CNS(=O)(=O)c2ccc(cc2)Cl)sc(c1C)C

STK673606
Synonyms: 3,6- dinitro- 9H- carbazole
Smiles: [O-][N+](=O)c1ccc2c(c1)c1cc(ccc1[nH]2)[N+](=O)[O-]

STK756416
Synonyms: N'- [(E)- {2- [(3- bromobenzyl)oxy]- 5- methoxyphenyl}methylidene]- 2- hydroxy- 2- phenylacetohydrazide
Smiles: COc1ccc(c(c1)/C=N/NC(=O)C(c1ccccc1)O)OCc1cccc(c1)Br

STK673612
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- (azepan- 1- ylmethyl)- N'- [(E)- (4- hydroxyphenyl)methylidene]- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: O=C(c1nnn(c1CN1CCCCCC1)c1nonc1N)N/N=C/c1ccc(cc1)O

STK756436
Synonyms: 1- [(E)- 2- nitroethenyl]naphthalen- 2- ylacetate
Smiles: CC(=O)Oc1ccc2c(c1/C=C/[N+](=O)[O-])cccc2

STK756440
Synonyms: (3Z)- 3- [(4- bromophenyl)imino]- 7- chloro- 1,3- dihydro- 2H- indol- 2- one
Smiles: Brc1ccc(cc1)/N=C/1\C(=O)Nc2c1cccc2Cl

STK673621
Synonyms: N- (pyridin- 4- yl)- 2,1,3- benzothiadiazole- 4- sulfonamide
Smiles: O=S(=O)(c1cccc2c1nsn2)Nc1ccncc1

STK756445
Synonyms: methyl2- amino- 4- (1,3- benzodioxol- 5- yl)- 7,7- dimethyl- 5- oxo- 1- [2- (trifluoromethyl)phenyl]- 1,4,5,6,7,8- hexahydroquinoline- 3- carboxylate
Smiles: COC(=O)C1=C(N)N(C2=C(C1c1ccc3c(c1)OCO3)C(=O)CC(C2)(C)C)c1ccccc1C(F)(F)F

STK673626
Synonyms: 3- (2,4- dinitrophenyl)- 1H- 1,2,4- triazol- 5- amine
Smiles: [O-][N+](=O)c1cc(ccc1c1n[nH]c(n1)N)[N+](=O)[O-]

STK673627
Synonyms: 5- ({(Z)- [2- (benzyloxy)- 3,5- diiodophenyl]methylidene}amino)- 1,3- dihydro- 2H- benzimidazol- 2- one
Smiles: Ic1cc(/C=N\c2ccc3c(c2)[nH]c(=O)[nH]3)c(c(c1)I)OCc1ccccc1

STK756457
Synonyms: N- (7- oxo- 5- phenyl- 4,7- dihydro[1,2,4]triazolo[1,5- a]pyrimidin- 2- yl)acetamide
Smiles: CC(=O)Nc1nn2c(n1)[nH]c(cc2=O)c1ccccc1

STK756462
Synonyms: N'- {(E)- [5- (3- chlorophenyl)furan- 2- yl]methylidene}- 2- [5- (2- chlorophenyl)- 2H- tetrazol- 2- yl]acetohydrazide
Smiles: Clc1cccc(c1)c1ccc(o1)/C=N/NC(=O)Cn1nnc(n1)c1ccccc1Cl

STK756464
Synonyms: 5- amino- 3- {(Z)- 1- cyano- 2- [3- nitro- 4- (piperidin- 1- yl)phenyl]ethenyl}- 1- (2- hydroxyethyl)- 1H- pyrazole- 4- carbonitrile
Smiles: OCCn1nc(c(c1N)C#N)/C(=C/c1ccc(c(c1)[N+](=O)[O-])N1CCCCC1)/C#N

STK756475
Synonyms: 4- tert- butyl- N- [2- ({2- oxo- 2- [(2- phenylethyl)amino]ethyl}sulfanyl)- 1,3- benzothiazol- 6- yl]benzamide
Smiles: O=C(CSc1nc2c(s1)cc(cc2)NC(=O)c1ccc(cc1)C(C)(C)C)NCCc1ccccc1

STK673642
Synonyms: {(2Z)- 2- [(2E)- (2,4- dimethoxybenzylidene)hydrazinylidene]- 4- oxo- 3- phenyl- 1,3- thiazolidin- 5- yl}aceticacid
Smiles: COc1cc(OC)ccc1/C=N/N=C/1\SC(C(=O)N1c1ccccc1)CC(=O)O

STK756478
Synonyms: 2- phenoxy- N'- {(E)- [2- (prop- 2- en- 1- yloxy)phenyl]methylidene}acetohydrazide
Smiles: C=CCOc1ccccc1/C=N/NC(=O)COc1ccccc1

STK673654
Synonyms: (1E)- 1- (3,4- dichlorobenzylidene)- 6- methyl- 4- thioxo- 4,5- dihydrofuro[3,4- c]pyridin- 3(1H)- one
Smiles: O=C1O/C(=C/c2ccc(c(c2)Cl)Cl)/c2c1c(=S)[nH]c(c2)C

STK673656
Synonyms: 5- bromo- 4- [(E)- (2- {4- [(furan- 2- ylmethyl)amino]- 6- [(4- methoxyphenyl)amino]- 1,3,5- triazin- 2- yl}hydrazinylidene)methyl]- 2- methoxyphenol
Smiles: COc1ccc(cc1)Nc1nc(N/N=C/c2cc(OC)c(cc2Br)O)nc(n1)NCc1ccco1

STK756489
Synonyms: (2E)- 2- (1H- benzimidazol- 2- yl)- 3- (pentafluorophenyl)prop- 2- enenitrile
Smiles: N#C/C(=C\c1c(F)c(F)c(c(c1F)F)F)/c1nc2c([nH]1)cccc2

STK756492
Synonyms: (2E)- 2- (1H- benzimidazol- 2- yl)- 3- (1- benzyl- 1H- indol- 3- yl)prop- 2- enenitrile
Smiles: N#C/C(=C\c1cn(c2c1cccc2)Cc1ccccc1)/c1nc2c([nH]1)cccc2

STK756495
Synonyms: 6- methyl- 3- {(2E)- 2- [1- (5- methylfuran- 2- yl)ethylidene]hydrazinyl}- 5H- [1,2,4]triazino[5,6- b]indole
Smiles: Cc1ccc(o1)/C(=N/Nc1nnc2c(n1)[nH]c1c2cccc1C)/C

STK673657
Synonyms: 2- [(1- bromonaphthalen- 2- yl)oxy]- N'- {(Z)- [3- (4- methylphenyl)- 1- phenyl- 1H- pyrazol- 4- yl]methylidene}butanehydrazide
Smiles: CCC(C(=O)N/N=C\c1cn(nc1c1ccc(cc1)C)c1ccccc1)Oc1ccc2c(c1Br)cccc2

STK756503
Synonyms: 4- [(E)- (4,5,6,7- tetrahydro- 1,3- benzothiazol- 2- ylimino)methyl]phenol
Smiles: Oc1ccc(cc1)/C=N/c1nc2c(s1)CCCC2

STK756510
Synonyms: N- (1,3- benzodioxol- 5- yl)- 4- (4- bromophenyl)- 1,3- thiazol- 2- amine
Smiles: Brc1ccc(cc1)c1csc(n1)Nc1ccc2c(c1)OCO2

STK756511
Synonyms: N- (1,3- benzodioxol- 5- yl)- 4- phenyl- 1,3- thiazol- 2- amine
Smiles: c1ccc(cc1)c1csc(n1)Nc1ccc2c(c1)OCO2

STK756512
Synonyms: 2- {3- [2- (1,3- benzodioxol- 5- ylamino)- 1,3- thiazol- 4- yl]phenyl}- 1H- isoindole- 1,3(2H)- dione
Smiles: O=C1N(c2cccc(c2)c2csc(n2)Nc2ccc3c(c2)OCO3)C(=O)c2c1cccc2

STK756514
Synonyms: N- (1,3- benzodioxol- 5- yl)- 4- (4- nitrophenyl)- 1,3- thiazol- 2- amine
Smiles: [O-][N+](=O)c1ccc(cc1)c1csc(n1)Nc1ccc2c(c1)OCO2

STK756518
Synonyms: 3,5- bis[(2,2- dimethylpropanoyl)amino]- N- (4- iodophenyl)benzamide
Smiles: Ic1ccc(cc1)NC(=O)c1cc(cc(c1)NC(=O)C(C)(C)C)NC(=O)C(C)(C)C

STK756520
Synonyms: methyl2- amino- 1- (4- bromophenyl)- 4- (4- methoxyphenyl)- 5- oxo- 1,4,5,6,7,8- hexahydroquinoline- 3- carboxylate
Smiles: COc1ccc(cc1)C1C(=C(N)N(C2=C1C(=O)CCC2)c1ccc(cc1)Br)C(=O)OC

STK756526
Synonyms: 4- (biphenyl- 4- yl)- 2- [5- (4- fluorophenyl)- 3- (thiophen- 2- yl)- 4,5- dihydro- 1H- pyrazol- 1- yl]- 1,3- thiazole
Smiles: Fc1ccc(cc1)C1CC(=NN1c1scc(n1)c1ccc(cc1)c1ccccc1)c1cccs1

STK673668
Synonyms: ethyl1- (3- {[4- (benzyloxy)phenyl]amino}- 3- oxopropyl)- 4- phenylpiperidine- 4- carboxylate
Smiles: CCOC(=O)C1(CCN(CC1)CCC(=O)Nc1ccc(cc1)OCc1ccccc1)c1ccccc1

STK756543
Synonyms: 5- amino- 3- {(Z)- 1- cyano- 2- [4- (4- methylpiperidin- 1- yl)- 3- nitrophenyl]ethenyl}- 1- phenyl- 1H- pyrazole- 4- carbonitrile
Smiles: N#C/C(=C\c1ccc(c(c1)[N+](=O)[O-])N1CCC(CC1)C)/c1nn(c(c1C#N)N)c1ccccc1

STK756547
Synonyms: 3- [4- (morpholin- 4- ylsulfonyl)phenyl]- 5,6- dihydroimidazo[2,1- b][1,3]thiazole
Smiles: O=S(=O)(c1ccc(cc1)c1csc2=NCCn12)N1CCOCC1

STK756549
Synonyms: 2- (5- amino- 1H- tetrazol- 1- yl)- N'- {(E)- [3- iodo- 5- methoxy- 4- (prop- 2- yn- 1- yloxy)phenyl]methylidene}acetohydrazide
Smiles: C#CCOc1c(I)cc(cc1OC)/C=N/NC(=O)Cn1nnnc1N

STK756552
Synonyms: Nalpha- [(benzyloxy)carbonyl]- N- (2,6- dimethylphenyl)tryptophanamide
Smiles: O=C(NC(C(=O)Nc1c(C)cccc1C)Cc1c[nH]c2c1cccc2)OCc1ccccc1

STK673679
Synonyms: ethyl1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- [(5H- [1,2,4]triazino[5,6- b]indol- 3- ylsulfanyl)methyl]- 1H- 1,2,3- triazole- 4- carboxylate
Smiles: CCOC(=O)c1nnn(c1CSc1nnc2c(n1)[nH]c1c2cccc1)c1nonc1N

STK756575
Synonyms: 4- amino- N'- [(E)- (4- fluorophenyl)methylidene]- 1,2,5- oxadiazole- 3- carbohydrazide
Smiles: Fc1ccc(cc1)/C=N/NC(=O)c1nonc1N

STK673686
Synonyms: 9- (4- hydroxyphenyl)- 2,2,7,7- tetramethyl- 3,4,5,6,7,9- hexahydro- 1H- xanthene- 1,8(2H)- dione
Smiles: Oc1ccc(cc1)C1C2=C(CCC(C2=O)(C)C)OC2=C1C(=O)C(CC2)(C)C

STK756587
Synonyms: 2,2- dimethyl- 5- (5- methylfuran- 2- yl)- 2,3,5,6- tetrahydrobenzo[a]phenanthridin- 4(1H)- one
Smiles: Cc1ccc(o1)C1Nc2ccc3c(c2C2=C1C(=O)CC(C2)(C)C)cccc3

STK673691
Synonyms: 4- fluoro- 3- (morpholin- 4- ylsulfonyl)benzoicacid
Smiles: OC(=O)c1ccc(c(c1)S(=O)(=O)N1CCOCC1)F

STK756606
Synonyms: N- phenyl- 2,1,3- benzothiadiazole- 5- carboxamide
Smiles: O=C(c1ccc2c(c1)nsn2)Nc1ccccc1

STK673692
Synonyms: ethyl(2E)- 5- (1,3- benzodioxol- 5- yl)- 2- (3,5- dibromo- 4- hydroxybenzylidene)- 7- methyl- 3- oxo- 2,3- dihydro- 5H- [1,3]thiazolo[3,2- a]pyrimidine- 6- carboxylate
Smiles: CCOC(=O)C1=C(C)N=c2n(C1c1ccc3c(c1)OCO3)c(=O)/c(=C\c1cc(Br)c(c(c1)Br)O)/s2

STK756625
Synonyms: 2- ({4- [(E)- {2- [1- (naphthalen- 1- yl)- 1H- tetrazol- 5- yl]hydrazinylidene}methyl]phenoxy}methyl)pyridine
Smiles: c1ccc(nc1)COc1ccc(cc1)/C=N/Nc1nnnn1c1cccc2c1cccc2

STK673705
Synonyms: 2- (4- nitrophenyl)- 2- oxoethyl4- (4- bromophenyl)- 3a,4,5,9b- tetrahydro- 3H- cyclopenta[c]quinoline- 8- carboxylate
Smiles: Brc1ccc(cc1)C1Nc2ccc(cc2C2C1CC=C2)C(=O)OCC(=O)c1ccc(cc1)[N+](=O)[O-]

STK756655
Synonyms: 1- [5- hydroxy- 5- (pyridin- 3- yl)- 3- (trifluoromethyl)- 4,5- dihydro- 1H- pyrazol- 1- yl]- 2- methylpropan- 1- one
Smiles: O=C(N1N=C(CC1(O)c1cccnc1)C(F)(F)F)C(C)C

STK673717
Synonyms: N- cyclohexyl- 2,1,3- benzothiadiazole- 5- carboxamide
Smiles: O=C(c1ccc2c(c1)nsn2)NC1CCCCC1

STK756659
Synonyms: (4- tert- butylphenyl)[5- hydroxy- 5- (3- methoxyphenyl)- 3- (trifluoromethyl)- 4,5- dihydro- 1H- pyrazol- 1- yl]methanone
Smiles: COc1cccc(c1)C1(O)CC(=NN1C(=O)c1ccc(cc1)C(C)(C)C)C(F)(F)F

STK756661
Synonyms: N- (1,3- benzodioxol- 5- yl)- 4- (4- iodophenyl)- 1,3- thiazol- 2- amine
Smiles: Ic1ccc(cc1)c1csc(n1)Nc1ccc2c(c1)OCO2

STK756662
Synonyms: N- (1,3- benzodioxol- 5- yl)- 4- (2,5- dimethylphenyl)- 1,3- thiazol- 2- amine
Smiles: Cc1ccc(c(c1)c1csc(n1)Nc1ccc2c(c1)OCO2)C

STK673723
Synonyms: 4- chloro- N- {2- [(4- iodobenzyl)sulfanyl]- 1,3- benzothiazol- 6- yl}benzamide
Smiles: Clc1ccc(cc1)C(=O)Nc1ccc2c(c1)sc(n2)SCc1ccc(cc1)I

STK756682
Synonyms: (2E)- 2- (1,3- benzodioxol- 5- ylmethylidene)- 6,7- dimethyl[1,3]thiazolo[3,2- a]benzimidazol- 3(2H)- one
Smiles: Cc1cc2nc3n(c2cc1C)c(=O)/c(=C\c1ccc2c(c1)OCO2)/s3

STK756693
Synonyms: N'- [(E)- (3- ethoxy- 4- hydroxyphenyl)methylidene]- 2- (9- oxoacridin- 10(9H)- yl)acetohydrazide
Smiles: CCOc1cc(/C=N/NC(=O)Cn2c3ccccc3c(=O)c3c2cccc3)ccc1O

STK756695
Synonyms: 3- (ethylsulfanyl)- N- [(E)- furan- 2- ylmethylidene]- 7H- [1,2,4]triazolo[4,3- b][1,2,4]triazol- 7- amine
Smiles: CCSc1nnc2n1ncn2/N=C/c1ccco1

STK756698
Synonyms: N- [(E)- (5- nitrofuran- 2- yl)methylidene]aniline
Smiles: [O-][N+](=O)c1ccc(o1)/C=N/c1ccccc1

STK756699
Synonyms: 5H- indeno[1,2- b]pyridin- 5- one
Smiles: O=C1c2ccccc2c2c1cccn2

STK756700
Synonyms: 11H- indeno[1,2- b]quinolin- 11- one
Smiles: O=C1c2ccccc2c2c1cc1ccccc1n2

STK756705
Synonyms: 6- bromo- 2- (thiophen- 2- yl)imidazo[1,2- a]pyridine
Smiles: Brc1ccc2n(c1)cc(n2)c1cccs1

STK673732
Synonyms: (2Z)- 3- amino- 4,4,4- trichloro- 2- cyano- N- (pyridin- 2- yl)but- 2- enamide
Smiles: N#C/C(=C(\C(Cl)(Cl)Cl)/[NH])/C(=O)Nc1ccccn1

STK673733
Synonyms: 1,1',1''- {[2- (phenylsulfonyl)ethene- 1,1,2- triyl]trisulfanediyl}tris(4- chlorobenzene)
Smiles: Clc1ccc(cc1)S/C(=C(\S(=O)(=O)c1ccccc1)/Sc1ccc(cc1)Cl)/Sc1ccc(cc1)Cl

STK756715
Synonyms: 2- oxo- 2- (10H- phenothiazin- 10- yl)ethyl1- benzofuran- 2- carboxylate
Smiles: O=C(c1cc2c(o1)cccc2)OCC(=O)N1c2ccccc2Sc2c1cccc2

STK756722
Synonyms: 6- [(2E)- 2- (3,4- dimethoxybenzylidene)hydrazinyl]- N- (2,3- dimethylphenyl)[1,2,5]oxadiazolo[3,4- b]pyrazin- 5- amine
Smiles: COc1cc(/C=N/Nc2nc3nonc3nc2Nc2cccc(c2C)C)ccc1OC

STK673742
Synonyms: (2E)- 3- (2- hydroxy- 5- nitrophenyl)- 2- (5- methyl- 1H- benzimidazol- 2- yl)prop- 2- enenitrile
Smiles: N#C/C(=C\c1cc(ccc1O)[N+](=O)[O-])/c1nc2c([nH]1)ccc(c2)C

STK673743
Synonyms: 4- {(2E)- 2- [3,5- diiodo- 2- (prop- 2- yn- 1- yloxy)benzylidene]hydrazinyl}- N- (4- fluorophenyl)- 6- (morpholin- 4- yl)- 1,3,5- triazin- 2- amine
Smiles: C#CCOc1c(/C=N/Nc2nc(Nc3ccc(cc3)F)nc(n2)N2CCOCC2)cc(cc1I)I

STK673746
Synonyms: 4- (4- benzylpiperidin- 1- yl)- 6- {(2E)- 2- [3,5- diiodo- 2- (prop- 2- yn- 1- yloxy)benzylidene]hydrazinyl}- N- (4- methylphenyl)- 1,3,5- triazin- 2- amine
Smiles: C#CCOc1c(/C=N/Nc2nc(Nc3ccc(cc3)C)nc(n2)N2CCC(CC2)Cc2ccccc2)cc(cc1I)I

STK756729
Synonyms: 4- {[(E)- (2- fluorophenyl)methylidene]amino}- N- (pyridin- 2- yl)benzenesulfonamide
Smiles: Fc1ccccc1/C=N/c1ccc(cc1)S(=O)(=O)Nc1ccccn1

STK673764
Synonyms: 4- ({[(4- methyl- 2- oxo- 2H- chromen- 6- yl)oxy]acetyl}amino)benzenesulfonicacid
Smiles: O=C(Nc1ccc(cc1)S(=O)(=O)O)COc1ccc2c(c1)c(C)cc(=O)o2

STK756758
Synonyms: (2E,5E)- 2,5- bis(4- methoxybenzylidene)cyclopentanone
Smiles: COc1ccc(cc1)/C=C/1\CC/C(=C\c2ccc(cc2)OC)/C1=O

STK756759
Synonyms: 2- benzyl- 4,6- dinitro- 1,2- benzothiazol- 3(2H)- one
Smiles: [O-][N+](=O)c1cc(cc2c1c(=O)n(s2)Cc1ccccc1)[N+](=O)[O-]

STK756760
Synonyms: 4,6- dinitro- 1,2- benzothiazol- 3(2H)- one
Smiles: [O-][N+](=O)c1cc(cc2c1c(=O)[nH]s2)[N+](=O)[O-]

STK673765
Synonyms: 1- (9H- fluoren- 2- yl)- 4- (piperidin- 1- yl)butan- 1- one
Smiles: O=C(c1ccc2c(c1)Cc1c2cccc1)CCCN1CCCCC1

STK673766
Synonyms: 4- benzyl- 1,2,5- trimethylpiperidin- 4- ol
Smiles: CC1CN(C)C(CC1(O)Cc1ccccc1)C

STK673767
Synonyms: 3,7- dimethyl- 9H- indeno[2,1- c]pyridin- 9- one
Smiles: Cc1ccc2c(c1)C(=O)c1c2cc(nc1)C

STK756761
Synonyms: 4- amino- 6- imino- 1- (4- methoxyphenyl)- 1,6- dihydropyridazine- 3,5- dicarbonitrile
Smiles: COc1ccc(cc1)n1nc(C#N)c(c(c1=N)C#N)N

STK756765
Synonyms: ethyl(2E)- 3- {5- phenyl- 3- [(E)- 2- phenylethenyl]- 4,5- dihydro- 1H- pyrazol- 1- yl}but- 2- enoate
Smiles: CCOC(=O)/C=C(/N1N=C(CC1c1ccccc1)/C=C/c1ccccc1)\C

STK756781
Synonyms: (2E)- 3- {4- [(2,4- dichlorobenzyl)oxy]phenyl}- 2- (5- methyl- 1H- benzimidazol- 2- yl)prop- 2- enenitrile
Smiles: N#C/C(=C\c1ccc(cc1)OCc1ccc(cc1Cl)Cl)/c1nc2c([nH]1)ccc(c2)C

STK673776
Synonyms: 2,6- dibromo- 4- (morpholin- 4- ylcarbonothioyl)phenylacetate
Smiles: S=C(c1cc(Br)c(c(c1)Br)OC(=O)C)N1CCOCC1

STK673779
Synonyms: 1- [2- (ethylsulfonyl)ethyl]piperidine
Smiles: CCS(=O)(=O)CCN1CCCCC1

STK756792
Synonyms: 2- [(2- {[2- (tert- butylsulfanyl)ethyl]sulfonyl}ethyl)sulfanyl]- 2- methylpropane
Smiles: CC(SCCS(=O)(=O)CCSC(C)(C)C)(C)C

STK673780
Synonyms: 3- benzyl- 1- (furan- 2- ylmethyl)- 7- methylpyrido[3,4- d]pyridazine- 4,5(3H,6H)- dione
Smiles: Cc1cc2c(Cc3ccco3)nn(c(=O)c2c(=O)[nH]1)Cc1ccccc1

STK673781
Synonyms: 2,4,4- triphenyl- 4H- 3,1- benzoxazine
Smiles: c1ccc(cc1)C1=Nc2ccccc2C(O1)(c1ccccc1)c1ccccc1

STK756794
Synonyms: ethyl3- [(4- phenylpiperazin- 1- yl)methyl]- 1- benzofuran- 2- carboxylate
Smiles: CCOC(=O)c1oc2c(c1CN1CCN(CC1)c1ccccc1)cccc2

STK673784
Synonyms: N- (2,5- dimethyl[1,3]oxazolo[5,4- d]pyrimidin- 7- yl)leucine
Smiles: CC(CC(C(=O)O)Nc1nc(C)nc2c1nc(o2)C)C

STK756799
Synonyms: N'- [(E)- 2,1,3- benzoxadiazol- 5- ylmethylidene]pyridine- 4- carbohydrazide
Smiles: O=C(c1ccncc1)N/N=C/c1ccc2c(c1)non2

STK756800
Synonyms: bis(4- chlorophenyl)cyclohexane- 1,3- dicarboxylate
Smiles: O=C(C1CCCC(C1)C(=O)Oc1ccc(cc1)Cl)Oc1ccc(cc1)Cl

STK756801
Synonyms: diethyl(3- acetyl- 2- oxo- 3,4- dihydro- 2H- chromen- 4- yl)phosphonate
Smiles: CCOP(=O)(C1C(C(=O)C)C(=O)Oc2c1cccc2)OCC

STK756802
Synonyms: 1- [3- (pyrrolidin- 1- yl)prop- 1- yn- 1- yl]cyclohexanol
Smiles: OC1(CCCCC1)C#CCN1CCCC1

STK756806
Synonyms: 4- methyl- 5- [2- (methylsulfanyl)ethyl]- 1,3- dihydro- 2H- imidazole- 2- thione
Smiles: Cc1c(CCSC)[nH]c(=S)[nH]1

STK756811
Synonyms: 2- hydroxyethyl(1,3- dioxo- 1,3- dihydro- 2H- isoindol- 2- yl)acetate
Smiles: OCCOC(=O)CN1C(=O)c2c(C1=O)cccc2

STK756814
Synonyms: N- (4- methylphenyl)- 2- (quinolin- 2- ylsulfanyl)acetamide
Smiles: O=C(Nc1ccc(cc1)C)CSc1ccc2c(n1)cccc2

STK673790
Synonyms: N'- [(E)- (2- nitrophenyl)methylidene]decane- 1- sulfonohydrazide
Smiles: CCCCCCCCCCS(=O)(=O)N/N=C/c1ccccc1[N+](=O)[O-]

STK673795
Synonyms: N'- [(E)- 1,3- benzodioxol- 5- ylmethylidene]decane- 1- sulfonohydrazide
Smiles: CCCCCCCCCCS(=O)(=O)N/N=C/c1ccc2c(c1)OCO2

STK673796
Synonyms: N'- [(E)- (4- hydroxyphenyl)methylidene]decane- 1- sulfonohydrazide
Smiles: CCCCCCCCCCS(=O)(=O)N/N=C/c1ccc(cc1)O

STK673799
Synonyms: N- (5- bromoquinolin- 7- yl)decane- 1- sulfonamide
Smiles: CCCCCCCCCCS(=O)(=O)Nc1cc(Br)c2c(c1)nccc2

STK756817
Synonyms: N'- [(E)- cyclohex- 3- en- 1- ylmethylidene]- 2- (pyridin- 2- ylsulfanyl)acetohydrazide
Smiles: O=C(CSc1ccccn1)N/N=C/C1CCC=CC1

STK756818
Synonyms: 2- (9H- fluoren- 9- ylidenemethyl)pyridine
Smiles: c1ccc(nc1)/C=C/1\c2ccccc2c2c1cccc2

STK756819
Synonyms: 2- (2,4- dimethylphenyl)quinoxaline
Smiles: Cc1ccc(c(c1)C)c1cnc2c(n1)cccc2

STK673802
Synonyms: 2,3,4- trimethylbenzo[h]quinoline
Smiles: Cc1nc2c(c(c1C)C)ccc1c2cccc1

STK756822
Synonyms: 2- [(7- amino- 7H- [1,2,4]triazolo[4,3- b][1,2,4]triazol- 3- yl)sulfanyl]- N- (4- sulfamoylphenyl)acetamide
Smiles: O=C(Nc1ccc(cc1)S(=O)(=O)N)CSc1nnc2n1ncn2N

STK673816
Synonyms: N- (4- phenyl- 1,3- thiazol- 2- yl)- 5- (piperidin- 1- yl)pentanamide
Smiles: O=C(Nc1scc(n1)c1ccccc1)CCCCN1CCCCC1

STK756834
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- (9H- fluoren- 9- ylidene)- 5- (3- nitrophenyl)- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: O=C(c1nnn(c1c1cccc(c1)[N+](=O)[O-])c1nonc1N)N/N=C/1\c2ccccc2c2c1cccc2

STK756837
Synonyms: (1,3- dioxo- 1,3- dihydro- 2H- isoindol- 2- yl)methyl[(6- amino- 3,5- dicyanopyridin- 2- yl)sulfanyl]acetate
Smiles: N#Cc1cc(C#N)c(nc1SCC(=O)OCN1C(=O)c2c(C1=O)cccc2)N

STK756840
Synonyms: phenyl2- [(6- methyl- 1,3- benzothiazol- 2- yl)carbamoyl]pyrrolidine- 1- carboxylate
Smiles: O=C(C1CCCN1C(=O)Oc1ccccc1)Nc1nc2c(s1)cc(cc2)C

STK756851
Synonyms: N- [4- ({6- [(4- bromophenyl)amino][1,2,5]oxadiazolo[3,4- b]pyrazin- 5- yl}amino)phenyl]acetamide
Smiles: CC(=O)Nc1ccc(cc1)Nc1nc2nonc2nc1Nc1ccc(cc1)Br

STK756853
Synonyms: methyl4- {4- [2- (azepan- 1- yl)- 2- oxoethoxy]phenyl}- 6- methyl- 2- oxo- 1,2,3,4- tetrahydropyrimidine- 5- carboxylate
Smiles: COC(=O)C1=C(C)NC(=O)NC1c1ccc(cc1)OCC(=O)N1CCCCCC1

STK756856
Synonyms: N- (4- chloro- 2,5- dimethoxyphenyl)- 4- (4- methylphenyl)- 1,3- thiazol- 2- amine
Smiles: COc1cc(Cl)c(cc1Nc1scc(n1)c1ccc(cc1)C)OC

STK756860
Synonyms: 3- benzyl- 4- hydroxy- 4- methyl- 1- oxa- 3- azaspiro[4.5]decan- 2- one
Smiles: O=C1OC2(C(N1Cc1ccccc1)(C)O)CCCCC2

STK756867
Synonyms: ethyl1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- {[(1- methyl- 1H- imidazol- 2- yl)sulfanyl]methyl}- 1H- 1,2,3- triazole- 4- carboxylate
Smiles: CCOC(=O)c1nnn(c1CSc1nccn1C)c1nonc1N

STK673827
Synonyms: 1,2',5,5'- tetraphenyl- 1H,2'H- 3,3'- bipyrazole
Smiles: c1ccc(cc1)c1nn(c(c1)c1nn(c(c1)c1ccccc1)c1ccccc1)c1ccccc1