67194428 -OEChem-05122423272D 72 75 0 1 0 0 0 0 0999 V2000 8.9282 3.6012 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 12.7328 -0.7049 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -1.8988 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 -2.3988 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 8.9282 -2.3988 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -0.3988 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.5738 -1.9920 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.2429 -2.7352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7429 -3.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7648 -3.3933 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7817 -1.0139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -1.8988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -0.8988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.3988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -0.3988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -0.8988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -0.8988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -1.8988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 0.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9641 -1.2648 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9641 0.4672 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 0.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.3988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 1.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 1.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 2.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 0.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 2.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.3988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 2.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 2.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0920 -1.6019 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7445 -3.0996 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6578 -2.2744 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5513 -4.1909 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3093 -3.8534 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1448 -3.3933 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7000 -4.0099 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6954 -0.3999 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1621 -0.9923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 -0.5888 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8617 -0.0984 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5252 -2.2088 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4272 -0.9548 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6541 -1.8017 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5010 -1.5748 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5010 0.1572 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2741 1.0042 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4272 0.7772 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8162 0.6012 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 1.2212 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5762 0.6012 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.0188 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 1.4112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5252 0.7912 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 1.4112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 2.4112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3503 0.0643 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1972 0.2912 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9703 1.1382 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5252 2.4112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 0.1382 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -0.7088 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 -0.9357 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3520 2.6012 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 3.2212 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1120 2.6012 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 36 1 0 0 0 0 2 11 1 0 0 0 0 2 47 1 0 0 0 0 3 17 2 0 0 0 0 4 7 1 0 0 0 0 4 10 1 0 0 0 0 4 12 1 0 0 0 0 5 12 2 0 0 0 0 5 18 1 0 0 0 0 6 16 1 0 0 0 0 6 17 1 0 0 0 0 6 23 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 6 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 38 1 0 0 0 0 8 39 1 0 0 0 0 9 10 1 0 0 0 0 9 40 1 0 0 0 0 9 41 1 0 0 0 0 10 42 1 0 0 0 0 10 43 1 0 0 0 0 11 44 1 0 0 0 0 11 45 1 0 0 0 0 12 13 1 0 0 0 0 13 15 2 0 0 0 0 13 46 1 0 0 0 0 14 17 1 0 0 0 0 14 19 1 0 0 0 0 14 21 1 0 0 0 0 14 22 1 0 0 0 0 15 16 1 0 0 0 0 15 20 1 0 0 0 0 16 18 2 0 0 0 0 18 48 1 0 0 0 0 19 24 2 0 0 0 0 19 25 1 0 0 0 0 20 26 2 0 0 0 0 20 29 1 0 0 0 0 21 49 1 0 0 0 0 21 50 1 0 0 0 0 21 51 1 0 0 0 0 22 52 1 0 0 0 0 22 53 1 0 0 0 0 22 54 1 0 0 0 0 23 55 1 0 0 0 0 23 56 1 0 0 0 0 23 57 1 0 0 0 0 24 27 1 0 0 0 0 24 58 1 0 0 0 0 25 28 2 0 0 0 0 25 59 1 0 0 0 0 26 31 1 0 0 0 0 26 32 1 0 0 0 0 27 30 2 0 0 0 0 27 34 1 0 0 0 0 28 30 1 0 0 0 0 28 35 1 0 0 0 0 29 33 2 0 0 0 0 29 60 1 0 0 0 0 30 61 1 0 0 0 0 31 36 2 0 0 0 0 31 62 1 0 0 0 0 32 63 1 0 0 0 0 32 64 1 0 0 0 0 32 65 1 0 0 0 0 33 36 1 0 0 0 0 33 66 1 0 0 0 0 34 67 1 0 0 0 0 34 68 1 0 0 0 0 34 69 1 0 0 0 0 35 70 1 0 0 0 0 35 71 1 0 0 0 0 35 72 1 0 0 0 0 M END > 67194428 > 1 > 738 > 5 > 1 > 6 > AAADcfB7MQAAAAAAAAAAAAAAAAAAAWAAAAA8YIAAAAAAAAAB0AAAHwAACAAADijhmg4/8JMIEgCoAjd3dACCgCkxEiAJ2CE4dJiKcHLAnZGUYAhshgLYyCeYmMKPgAACAAAQAAAAAAQAACAAAAAAAAAAAA== > 2-(3,5-dimethylphenyl)-N-[4-(4-fluoro-2-methyl-phenyl)-6-[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]-3-pyridyl]-N,2-dimethyl-propanamide > 2-(3,5-dimethylphenyl)-N-[4-(4-fluoro-2-methylphenyl)-6-[(2S)-2-(hydroxymethyl)-1-pyrrolidinyl]-3-pyridinyl]-N,2-dimethylpropanamide > 2-(3,5-dimethylphenyl)-N-[4-(4-fluoro-2-methylphenyl)-6-[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]pyridin-3-yl]-N,2-dimethylpropanamide > 2-(3,5-dimethylphenyl)-N-[4-(4-fluoro-2-methylphenyl)-6-[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]pyridin-3-yl]-N,2-dimethylpropanamide > 2-(3,5-dimethylphenyl)-N-[4-(4-fluoranyl-2-methyl-phenyl)-6-[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]pyridin-3-yl]-N,2-dimethyl-propanamide > 2-(3,5-dimethylphenyl)-N-[4-(4-fluoro-2-methyl-phenyl)-6-[(2S)-2-methylolpyrrolidino]-3-pyridyl]-N,2-dimethyl-propionamide > InChI=1S/C30H36FN3O2/c1-19-12-20(2)14-22(13-19)30(4,5)29(36)33(6)27-17-32-28(34-11-7-8-24(34)18-35)16-26(27)25-10-9-23(31)15-21(25)3/h9-10,12-17,24,35H,7-8,11,18H2,1-6H3/t24-/m0/s1 > FDLOZDLSEDOTNN-DEOSSOPVSA-N > 5.9 > 489.27915556 > C30H36FN3O2 > 489.6 > CC1=CC(=CC(=C1)C(C)(C)C(=O)N(C)C2=CN=C(C=C2C3=C(C=C(C=C3)F)C)N4CCCC4CO)C > CC1=CC(=CC(=C1)C(C)(C)C(=O)N(C)C2=CN=C(C=C2C3=C(C=C(C=C3)F)C)N4CCC[C@H]4CO)C > 56.7 > 489.27915556 > 0 > 36 > 1 > 0 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 12 13 8 13 15 8 15 16 8 16 18 8 19 24 8 19 25 8 20 26 8 20 29 8 24 27 8 25 28 8 26 31 8 27 30 8 28 30 8 29 33 8 31 36 8 33 36 8 5 12 8 5 18 8 7 11 6 $$$$