11168541 -OEChem-06181302182D 69 72 0 1 0 0 0 0 0999 V2000 2.0000 0.5283 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 4.5283 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.7320 3.5283 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 4.7320 3.5283 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 10.2295 -4.1135 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -0.9717 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 -1.4717 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -1.4717 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 0.5283 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.7648 -2.4662 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.7429 -2.6741 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2429 -1.8081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5738 -1.0649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0216 -3.1353 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -0.9717 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 0.0283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.5283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 0.5283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 0.0283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 0.0283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -0.9717 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.0283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 1.5283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9641 -0.3377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9641 1.3944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 1.5283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 2.0283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 2.0283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.5283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 2.0283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 2.5283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.0283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 3.0283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 2.0283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 1.5283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 3.0283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 3.5283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 3.5283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1860 -2.2440 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5513 -3.2638 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3093 -2.9263 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7445 -2.1725 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6578 -1.3473 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0754 -0.7005 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2638 -0.5280 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6931 -2.6095 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4468 -3.3676 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 0.3383 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7688 -4.5283 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5252 -1.2817 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4272 -0.0277 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6541 -0.8746 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5010 -0.6477 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5010 1.0844 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2741 1.9313 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4272 1.7044 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8162 1.5283 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 2.1483 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5762 1.5283 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 2.3383 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.0917 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5252 1.7183 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 3.3383 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 2.3383 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3503 0.9914 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1972 1.2183 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9703 2.0653 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5252 3.3383 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 4.1483 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 32 1 0 0 0 0 2 38 1 0 0 0 0 3 38 1 0 0 0 0 4 38 1 0 0 0 0 5 14 1 0 0 0 0 5 49 1 0 0 0 0 6 20 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 21 1 0 0 0 0 9 19 1 0 0 0 0 9 20 1 0 0 0 0 9 26 1 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 10 39 1 0 0 0 0 11 12 1 0 0 0 0 11 40 1 0 0 0 0 11 41 1 0 0 0 0 12 13 1 0 0 0 0 12 42 1 0 0 0 0 12 43 1 0 0 0 0 13 44 1 0 0 0 0 13 45 1 0 0 0 0 14 46 1 0 0 0 0 14 47 1 0 0 0 0 15 16 1 0 0 0 0 16 18 2 0 0 0 0 16 48 1 0 0 0 0 17 20 1 0 0 0 0 17 22 1 0 0 0 0 17 24 1 0 0 0 0 17 25 1 0 0 0 0 18 19 1 0 0 0 0 18 23 1 0 0 0 0 19 21 2 0 0 0 0 21 50 1 0 0 0 0 22 28 2 0 0 0 0 22 29 1 0 0 0 0 23 27 1 0 0 0 0 23 30 2 0 0 0 0 24 51 1 0 0 0 0 24 52 1 0 0 0 0 24 53 1 0 0 0 0 25 54 1 0 0 0 0 25 55 1 0 0 0 0 25 56 1 0 0 0 0 26 57 1 0 0 0 0 26 58 1 0 0 0 0 26 59 1 0 0 0 0 27 33 2 0 0 0 0 27 35 1 0 0 0 0 28 31 1 0 0 0 0 28 60 1 0 0 0 0 29 32 2 0 0 0 0 29 61 1 0 0 0 0 30 36 1 0 0 0 0 30 62 1 0 0 0 0 31 34 2 0 0 0 0 31 38 1 0 0 0 0 32 34 1 0 0 0 0 33 37 1 0 0 0 0 33 63 1 0 0 0 0 34 64 1 0 0 0 0 35 65 1 0 0 0 0 35 66 1 0 0 0 0 35 67 1 0 0 0 0 36 37 2 0 0 0 0 36 68 1 0 0 0 0 37 69 1 0 0 0 0 M END > 11168541 > 1 > 809 > 8 > 1 > 6 > AAADceB7McAAAAAAAAAAAAAAAAAAAWAAAAA8YIAAAAAAAAAB0AAAHwAACAAADijhmh4/8JMIEgCoAjd3dACCgCkxEiAJ2CE4dJiKcHLAnZGUYAhshgLYyCeYmMKPgAACAAAQAAAAAAQAACAAAAAAAAAAAA== > 2-[3-fluoro-5-(trifluoromethyl)phenyl]-N-[6-[2-(hydroxymethyl)pyrrolidin-1-yl]-4-(o-tolyl)-3-pyridyl]-N,2-dimethyl-propanamide > 2-[3-fluoro-5-(trifluoromethyl)phenyl]-N-[6-[2-(hydroxymethyl)-1-pyrrolidinyl]-4-(2-methylphenyl)-3-pyridinyl]-N,2-dimethylpropanamide > 2-[3-fluoro-5-(trifluoromethyl)phenyl]-N-[6-[2-(hydroxymethyl)pyrrolidin-1-yl]-4-(2-methylphenyl)pyridin-3-yl]-N,2-dimethylpropanamide > 2-[3-fluoranyl-5-(trifluoromethyl)phenyl]-N-[6-[2-(hydroxymethyl)pyrrolidin-1-yl]-4-(2-methylphenyl)pyridin-3-yl]-N,2-dimethyl-propanamide > 2-[3-fluoro-5-(trifluoromethyl)phenyl]-N,2-dimethyl-N-[6-(2-methylolpyrrolidino)-4-(o-tolyl)-3-pyridyl]propionamide > InChI=1S/C29H31F4N3O2/c1-18-8-5-6-10-23(18)24-15-26(36-11-7-9-22(36)17-37)34-16-25(24)35(4)27(38)28(2,3)19-12-20(29(31,32)33)14-21(30)13-19/h5-6,8,10,12-16,22,37H,7,9,11,17H2,1-4H3 > DWUJDKXEYKICRI-UHFFFAOYSA-N > 6 > 529.23524 > C29H31F4N3O2 > 529.568953 > CC1=CC=CC=C1C2=CC(=NC=C2N(C)C(=O)C(C)(C)C3=CC(=CC(=C3)F)C(F)(F)F)N4CCCC4CO > CC1=CC=CC=C1C2=CC(=NC=C2N(C)C(=O)C(C)(C)C3=CC(=CC(=C3)F)C(F)(F)F)N4CCCC4CO > 56.7 > 529.23524 > 0 > 38 > 0 > 1 > 0 > 0 > 0 > 1 > 1 > 1 5 255 > 10 14 3 15 16 8 16 18 8 18 19 8 19 21 8 22 28 8 22 29 8 23 27 8 23 30 8 27 33 8 28 31 8 29 32 8 30 36 8 31 34 8 32 34 8 33 37 8 36 37 8 8 15 8 8 21 8 $$$$