46889694 -OEChem-05052400212D 69 72 0 1 0 0 0 0 0999 V2000 8.0622 2.4136 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -5.0864 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 3.3660 -5.4524 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.3660 -3.7204 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -5.0864 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 5.8301 -5.4524 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 6.8301 -3.7204 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.9609 4.8615 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.0864 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 3.9136 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 4.5981 2.4136 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.0864 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6551 4.5014 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.9641 5.4524 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9641 5.4524 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2731 4.5014 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7040 4.1924 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 2.9136 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.5864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 2.4136 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 1.4136 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.9136 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.5864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.5864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.4136 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5981 -1.5864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5981 -1.5864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 0.9136 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -3.0864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.0864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -0.5864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -4.0864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -4.0864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -4.5864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 1.4136 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -0.0864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -4.5864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -4.5864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 0.9136 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -0.5864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -0.0864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5581 3.8890 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0289 6.0690 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3576 5.5813 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5706 5.5813 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8993 6.0690 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5831 3.9644 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8395 4.7536 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2155 3.8106 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9951 3.6449 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 2.7236 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3712 4.6699 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0611 1.1036 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5981 -2.2064 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2181 -1.5864 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5981 -0.9664 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5981 -0.9664 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9781 -1.5864 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5981 -2.2064 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -2.7764 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 -2.7764 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0201 -1.1233 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 -0.8964 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6401 -0.0495 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -5.2064 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6592 -0.3964 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 1.2236 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -1.2064 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 -0.3964 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 35 1 0 0 0 0 2 37 1 0 0 0 0 3 37 1 0 0 0 0 4 37 1 0 0 0 0 5 38 1 0 0 0 0 6 38 1 0 0 0 0 7 38 1 0 0 0 0 8 17 1 0 0 0 0 8 52 1 0 0 0 0 9 23 2 0 0 0 0 10 13 1 0 0 0 0 10 16 1 0 0 0 0 10 18 1 0 0 0 0 11 18 2 0 0 0 0 11 25 1 0 0 0 0 12 22 1 0 0 0 0 12 23 1 0 0 0 0 12 31 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 1 0 0 0 13 42 1 0 0 0 0 14 15 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 15 45 1 0 0 0 0 15 46 1 0 0 0 0 16 47 1 0 0 0 0 16 48 1 0 0 0 0 17 49 1 0 0 0 0 17 50 1 0 0 0 0 18 20 1 0 0 0 0 19 23 1 0 0 0 0 19 24 1 0 0 0 0 19 26 1 0 0 0 0 19 27 1 0 0 0 0 20 21 2 0 0 0 0 20 51 1 0 0 0 0 21 22 1 0 0 0 0 21 28 1 0 0 0 0 22 25 2 0 0 0 0 24 29 2 0 0 0 0 24 30 1 0 0 0 0 25 53 1 0 0 0 0 26 54 1 0 0 0 0 26 55 1 0 0 0 0 26 56 1 0 0 0 0 27 57 1 0 0 0 0 27 58 1 0 0 0 0 27 59 1 0 0 0 0 28 35 1 0 0 0 0 28 36 2 0 0 0 0 29 32 1 0 0 0 0 29 60 1 0 0 0 0 30 33 2 0 0 0 0 30 61 1 0 0 0 0 31 62 1 0 0 0 0 31 63 1 0 0 0 0 31 64 1 0 0 0 0 32 34 2 0 0 0 0 32 38 1 0 0 0 0 33 34 1 0 0 0 0 33 37 1 0 0 0 0 34 65 1 0 0 0 0 35 39 2 0 0 0 0 36 40 1 0 0 0 0 36 66 1 0 0 0 0 39 41 1 0 0 0 0 39 67 1 0 0 0 0 40 41 2 0 0 0 0 40 68 1 0 0 0 0 41 69 1 0 0 0 0 M END > 46889694 > 1 > 881 > 10 > 1 > 6 > AAADceB7McAEAAAAAAAAAAAAAAAAAWAAAAA8YIAAAAAAAAAB0AAAHwIACAAADirhmjY/8JMIEgCoAjd3dACCgCkxFyAJ2CE4dpiKcHLBn5GUYAhshgLYyCeYmMKPgAACAAABAAAAAAQAAAIAAAAAAAAAAA== > 2-[3,5-bis(trifluoromethyl)phenyl]-N-[4-(2-chlorophenyl)-6-[(2R)-2-(hydroxymethyl)pyrrolidin-1-yl]-3-pyridyl]-N,2-dimethyl-propanamide > 2-[3,5-bis(trifluoromethyl)phenyl]-N-[4-(2-chlorophenyl)-6-[(2R)-2-(hydroxymethyl)-1-pyrrolidinyl]-3-pyridinyl]-N,2-dimethylpropanamide > 2-[3,5-bis(trifluoromethyl)phenyl]-N-[4-(2-chlorophenyl)-6-[(2R)-2-(hydroxymethyl)pyrrolidin-1-yl]pyridin-3-yl]-N,2-dimethylpropanamide > 2-[3,5-bis(trifluoromethyl)phenyl]-N-[4-(2-chlorophenyl)-6-[(2R)-2-(hydroxymethyl)pyrrolidin-1-yl]pyridin-3-yl]-N,2-dimethylpropanamide > 2-[3,5-bis(trifluoromethyl)phenyl]-N-[4-(2-chlorophenyl)-6-[(2R)-2-(hydroxymethyl)pyrrolidin-1-yl]pyridin-3-yl]-N,2-dimethyl-propanamide > 2-[3,5-bis(trifluoromethyl)phenyl]-N-[4-(2-chlorophenyl)-6-[(2R)-2-methylolpyrrolidino]-3-pyridyl]-N,2-dimethyl-propionamide > InChI=1S/C29H28ClF6N3O2/c1-27(2,17-11-18(28(31,32)33)13-19(12-17)29(34,35)36)26(41)38(3)24-15-37-25(39-10-6-7-20(39)16-40)14-22(24)21-8-4-5-9-23(21)30/h4-5,8-9,11-15,20,40H,6-7,10,16H2,1-3H3/t20-/m1/s1 > XDFFVHQCALIXPH-HXUWFJFHSA-N > 7.1 > 599.1774238 > C29H28ClF6N3O2 > 600.0 > CC(C)(C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)C(=O)N(C)C2=CN=C(C=C2C3=CC=CC=C3Cl)N4CCCC4CO > CC(C)(C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)C(=O)N(C)C2=CN=C(C=C2C3=CC=CC=C3Cl)N4CCC[C@@H]4CO > 56.7 > 599.1774238 > 0 > 41 > 1 > 0 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 11 18 8 11 25 8 13 17 5 18 20 8 20 21 8 21 22 8 22 25 8 24 29 8 24 30 8 28 35 8 28 36 8 29 32 8 30 33 8 32 34 8 33 34 8 35 39 8 36 40 8 39 41 8 40 41 8 $$$$