3215387 -OEChem-03282411382D 61 64 0 1 0 0 0 0 0999 V2000 3.4782 -1.2445 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.5827 -3.2500 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 7.0468 -1.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4487 1.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9128 0.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 -0.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.5864 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.7788 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7788 -1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6448 0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6448 -1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5109 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5109 -1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0468 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 0.2500 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.1808 1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 -1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4487 0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0468 1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5827 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4487 -1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 -1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0468 2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6691 0.1567 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4487 -2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 -2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 -3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5000 -1.4524 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4612 1.1349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0933 -2.3660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2419 -0.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1682 -1.1423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5668 -1.8326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0434 0.7249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2463 0.7249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2463 -2.2250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0434 -2.2250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1215 -0.3577 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7229 0.3326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7229 -1.8326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1215 -1.1423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9128 0.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 -0.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7778 1.4400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5837 1.4400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9118 -1.4400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7177 -1.4400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7778 3.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5837 3.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 3.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7177 -3.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 -3.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0677 1.2638 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3323 1.7413 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8548 1.0060 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5269 -2.1138 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8411 -2.9324 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6597 -2.6182 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 21 1 0 0 0 0 1 31 1 0 0 0 0 2 28 1 0 0 0 0 3 14 2 0 0 0 0 4 18 2 0 0 0 0 5 8 1 0 0 0 0 5 14 1 0 0 0 0 5 45 1 0 0 0 0 6 15 1 0 0 0 0 6 17 1 0 0 0 0 6 18 1 0 0 0 0 7 27 1 0 0 0 0 7 31 2 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 34 1 0 0 0 0 9 11 1 0 0 0 0 9 35 1 0 0 0 0 9 36 1 0 0 0 0 10 12 1 0 0 0 0 10 37 1 0 0 0 0 10 38 1 0 0 0 0 11 13 1 0 0 0 0 11 39 1 0 0 0 0 11 40 1 0 0 0 0 12 13 1 0 0 0 0 12 41 1 0 0 0 0 12 42 1 0 0 0 0 13 43 1 0 0 0 0 13 44 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 46 1 0 0 0 0 16 19 2 0 0 0 0 16 20 1 0 0 0 0 17 22 2 0 0 0 0 17 23 1 0 0 0 0 18 21 1 0 0 0 0 19 24 1 0 0 0 0 19 47 1 0 0 0 0 20 25 2 0 0 0 0 20 48 1 0 0 0 0 21 27 2 0 0 0 0 22 28 1 0 0 0 0 22 49 1 0 0 0 0 23 29 2 0 0 0 0 23 50 1 0 0 0 0 24 26 2 0 0 0 0 24 51 1 0 0 0 0 25 26 1 0 0 0 0 25 52 1 0 0 0 0 26 53 1 0 0 0 0 27 32 1 0 0 0 0 28 30 2 0 0 0 0 29 30 1 0 0 0 0 29 54 1 0 0 0 0 30 55 1 0 0 0 0 31 33 1 0 0 0 0 32 56 1 0 0 0 0 32 57 1 0 0 0 0 32 58 1 0 0 0 0 33 59 1 0 0 0 0 33 60 1 0 0 0 0 33 61 1 0 0 0 0 M END > 3215387 > 1 > 668 > 5 > 1 > 6 > AAADceB7MQBAAAAAAAAAAAAAAAAAAWAAAAAwYMAAAAAAAAAB0AAAHwQQAAAADCjB3gwywZPIEAisAyVyVACC8KBlCjgImJW4ZMgIYDrg1bGUIYhglgDoyUcYiICOAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA== > N-[2-(cyclohexylamino)-2-oxo-1-phenyl-ethyl]-N-(3-fluorophenyl)-2,4-dimethyl-thiazole-5-carboxamide > N-[2-(cyclohexylamino)-2-oxo-1-phenylethyl]-N-(3-fluorophenyl)-2,4-dimethyl-5-thiazolecarboxamide > N-[2-(cyclohexylamino)-2-oxo-1-phenylethyl]-N-(3-fluorophenyl)-2,4-dimethyl-1,3-thiazole-5-carboxamide > N-[2-(cyclohexylamino)-2-oxo-1-phenylethyl]-N-(3-fluorophenyl)-2,4-dimethyl-1,3-thiazole-5-carboxamide > N-[2-(cyclohexylamino)-2-oxidanylidene-1-phenyl-ethyl]-N-(3-fluorophenyl)-2,4-dimethyl-1,3-thiazole-5-carboxamide > N-[2-(cyclohexylamino)-2-keto-1-phenyl-ethyl]-N-(3-fluorophenyl)-2,4-dimethyl-thiazole-5-carboxamide > InChI=1S/C26H28FN3O2S/c1-17-24(33-18(2)28-17)26(32)30(22-15-9-12-20(27)16-22)23(19-10-5-3-6-11-19)25(31)29-21-13-7-4-8-14-21/h3,5-6,9-12,15-16,21,23H,4,7-8,13-14H2,1-2H3,(H,29,31) > QZFXFZLRFDOSNP-UHFFFAOYSA-N > 6.1 > 465.18862648 > C26H28FN3O2S > 465.6 > CC1=C(SC(=N1)C)C(=O)N(C2=CC(=CC=C2)F)C(C3=CC=CC=C3)C(=O)NC4CCCCC4 > CC1=C(SC(=N1)C)C(=O)N(C2=CC(=CC=C2)F)C(C3=CC=CC=C3)C(=O)NC4CCCCC4 > 90.5 > 465.18862648 > 0 > 33 > 0 > 1 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 1 21 8 1 31 8 15 14 3 16 19 8 16 20 8 17 22 8 17 23 8 19 24 8 20 25 8 21 27 8 22 28 8 23 29 8 24 26 8 25 26 8 28 30 8 29 30 8 7 27 8 7 31 8 $$$$