67193954 -OEChem-05052413282D 64 67 0 1 0 0 0 0 0999 V2000 10.6603 2.0283 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.0283 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 4.0283 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 13.2375 -1.2035 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2295 -3.6135 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -0.4717 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 -0.9717 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 8.9282 -0.9717 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 1.0283 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.7648 -1.9662 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 11.7429 -2.1741 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2429 -1.3081 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 11.5738 -0.5649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0216 -2.6353 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -0.4717 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 0.5283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 1.0283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.0283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 0.5283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -0.4717 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 0.5283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.5283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 2.0283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9641 0.1623 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9641 1.8944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 2.0283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 2.5283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.0283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 2.5283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 2.5283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.5283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 3.0283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 3.5283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 3.5283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 2.5283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 4.0283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1860 -1.7440 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5513 -2.7638 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3093 -2.4263 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4651 -0.7293 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0754 -0.2005 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2638 -0.0280 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6931 -2.1095 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4468 -2.8676 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6019 -1.7051 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 0.8383 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7688 -4.0283 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5252 -0.7817 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4272 0.4723 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6541 -0.3746 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5010 -0.1477 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5010 1.5844 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2741 2.4313 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4272 2.2044 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8162 2.0283 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 2.6483 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5762 2.0283 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 2.8383 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.4083 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5252 2.2183 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 3.8383 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5252 3.8383 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 2.8383 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 4.6483 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 29 1 0 0 0 0 2 31 1 0 0 0 0 3 32 1 0 0 0 0 12 4 1 6 0 0 0 4 45 1 0 0 0 0 5 14 1 0 0 0 0 5 47 1 0 0 0 0 6 21 2 0 0 0 0 7 10 1 0 0 0 0 7 13 1 0 0 0 0 7 15 1 0 0 0 0 8 15 2 0 0 0 0 8 20 1 0 0 0 0 9 19 1 0 0 0 0 9 21 1 0 0 0 0 9 26 1 0 0 0 0 10 11 1 0 0 0 0 10 14 1 1 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 12 40 1 0 0 0 0 13 41 1 0 0 0 0 13 42 1 0 0 0 0 14 43 1 0 0 0 0 14 44 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 46 1 0 0 0 0 17 19 1 0 0 0 0 17 23 1 0 0 0 0 18 21 1 0 0 0 0 18 22 1 0 0 0 0 18 24 1 0 0 0 0 18 25 1 0 0 0 0 19 20 2 0 0 0 0 20 48 1 0 0 0 0 22 27 2 0 0 0 0 22 28 1 0 0 0 0 23 29 1 0 0 0 0 23 30 2 0 0 0 0 24 49 1 0 0 0 0 24 50 1 0 0 0 0 24 51 1 0 0 0 0 25 52 1 0 0 0 0 25 53 1 0 0 0 0 25 54 1 0 0 0 0 26 55 1 0 0 0 0 26 56 1 0 0 0 0 26 57 1 0 0 0 0 27 32 1 0 0 0 0 27 58 1 0 0 0 0 28 31 2 0 0 0 0 28 59 1 0 0 0 0 29 33 2 0 0 0 0 30 34 1 0 0 0 0 30 60 1 0 0 0 0 31 35 1 0 0 0 0 32 35 2 0 0 0 0 33 36 1 0 0 0 0 33 61 1 0 0 0 0 34 36 2 0 0 0 0 34 62 1 0 0 0 0 35 63 1 0 0 0 0 36 64 1 0 0 0 0 M END > 67193954 > 1 > 749 > 5 > 2 > 6 > AAADceB7MAAGAAAAAAAAAAAAAAAAAWAAAAA8YIAAAAAAAAAB0AAAHgIACAAADj7hmiY/8JMIEgCoAjd3dACCgCkxFyAJ2CE4dpiKcHLBn5GUYAhuhgLYyCfYmMKPgAAAIACBAAAAAABAAQIAAAAAAAAAAA== > N-[4-(2-chlorophenyl)-6-[(2S,4R)-4-hydroxy-2-(hydroxymethyl)pyrrolidin-1-yl]-3-pyridyl]-2-(3,5-dichlorophenyl)-N,2-dimethyl-propanamide > N-[4-(2-chlorophenyl)-6-[(2S,4R)-4-hydroxy-2-(hydroxymethyl)-1-pyrrolidinyl]-3-pyridinyl]-2-(3,5-dichlorophenyl)-N,2-dimethylpropanamide > N-[4-(2-chlorophenyl)-6-[(2S,4R)-4-hydroxy-2-(hydroxymethyl)pyrrolidin-1-yl]pyridin-3-yl]-2-(3,5-dichlorophenyl)-N,2-dimethylpropanamide > N-[4-(2-chlorophenyl)-6-[(2S,4R)-4-hydroxy-2-(hydroxymethyl)pyrrolidin-1-yl]pyridin-3-yl]-2-(3,5-dichlorophenyl)-N,2-dimethylpropanamide > 2-[3,5-bis(chloranyl)phenyl]-N-[4-(2-chlorophenyl)-6-[(2S,4R)-2-(hydroxymethyl)-4-oxidanyl-pyrrolidin-1-yl]pyridin-3-yl]-N,2-dimethyl-propanamide > N-[4-(2-chlorophenyl)-6-[(2S,4R)-4-hydroxy-2-methylol-pyrrolidino]-3-pyridyl]-2-(3,5-dichlorophenyl)-N,2-dimethyl-propionamide > InChI=1S/C27H28Cl3N3O3/c1-27(2,16-8-17(28)10-18(29)9-16)26(36)32(3)24-13-31-25(33-14-20(35)11-19(33)15-34)12-22(24)21-6-4-5-7-23(21)30/h4-10,12-13,19-20,34-35H,11,14-15H2,1-3H3/t19-,20+/m0/s1 > JURLAYIQAMGEGT-VQTJNVASSA-N > 5.6 > 547.119625 > C27H28Cl3N3O3 > 548.9 > CC(C)(C1=CC(=CC(=C1)Cl)Cl)C(=O)N(C)C2=CN=C(C=C2C3=CC=CC=C3Cl)N4CC(CC4CO)O > CC(C)(C1=CC(=CC(=C1)Cl)Cl)C(=O)N(C)C2=CN=C(C=C2C3=CC=CC=C3Cl)N4C[C@@H](C[C@H]4CO)O > 76.9 > 547.119625 > 0 > 36 > 2 > 0 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 10 14 5 15 16 8 16 17 8 17 19 8 19 20 8 22 27 8 22 28 8 23 29 8 23 30 8 27 32 8 28 31 8 29 33 8 30 34 8 31 35 8 32 35 8 33 36 8 34 36 8 12 4 6 8 15 8 8 20 8 $$$$