53383465 -OEChem-05052408342D 69 72 0 1 0 0 0 0 0999 V2000 10.1603 4.1830 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 3.8170 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 11.1603 2.4510 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 6.8301 -2.0490 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.6830 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 0.3170 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.6830 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -0.1830 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -1.1830 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 1.8170 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -2.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -3.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -1.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 0.3170 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.4641 0.3170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 1.3170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -0.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.3170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -1.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 1.8170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5702 -0.2177 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -4.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5702 1.8516 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -2.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4282 -2.5490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4282 -0.8170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6641 0.2962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6641 1.3378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 2.8170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 1.3170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 3.3170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 1.8170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 2.8170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 3.3170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.0630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9966 -0.7081 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1996 -0.7081 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6762 -3.2656 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0747 -2.5753 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5200 -1.1004 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1215 -1.7907 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1996 -3.6580 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9966 -3.6580 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -0.3030 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7522 -1.7199 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5773 -0.8376 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2460 -4.1830 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -4.8030 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4860 -4.1830 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5773 2.4716 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4842 -2.7200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 -2.4930 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1042 -1.6461 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8913 -2.2390 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1182 -3.0860 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9651 -2.8590 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9651 -1.1270 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7382 -0.2801 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8913 -0.5070 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1284 -0.0159 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1284 1.6499 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5252 3.1270 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 0.6970 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 3.9370 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 1.5070 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 38 1 0 0 0 0 2 38 1 0 0 0 0 3 38 1 0 0 0 0 4 16 2 0 0 0 0 5 20 2 0 0 0 0 6 21 2 0 0 0 0 7 14 1 0 0 0 0 7 15 1 0 0 0 0 7 20 1 0 0 0 0 8 16 1 0 0 0 0 8 17 1 0 0 0 0 8 18 1 0 0 0 0 9 21 1 0 0 0 0 9 23 1 0 0 0 0 9 49 1 0 0 0 0 10 19 2 0 0 0 0 10 22 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 16 1 0 0 0 0 11 39 1 0 0 0 0 12 14 1 0 0 0 0 12 40 1 0 0 0 0 12 41 1 0 0 0 0 13 15 1 0 0 0 0 13 42 1 0 0 0 0 13 43 1 0 0 0 0 14 44 1 0 0 0 0 14 45 1 0 0 0 0 15 46 1 0 0 0 0 15 47 1 0 0 0 0 17 19 1 0 0 0 0 17 21 1 0 0 0 0 17 48 1 0 0 0 0 18 22 1 0 0 0 0 18 25 2 0 0 0 0 19 24 1 0 0 0 0 20 26 1 0 0 0 0 22 27 2 0 0 0 0 23 28 1 0 0 0 0 23 29 1 0 0 0 0 23 30 1 0 0 0 0 24 33 2 0 0 0 0 24 34 1 0 0 0 0 25 31 1 0 0 0 0 25 50 1 0 0 0 0 26 51 1 0 0 0 0 26 52 1 0 0 0 0 26 53 1 0 0 0 0 27 32 1 0 0 0 0 27 54 1 0 0 0 0 28 55 1 0 0 0 0 28 56 1 0 0 0 0 28 57 1 0 0 0 0 29 58 1 0 0 0 0 29 59 1 0 0 0 0 29 60 1 0 0 0 0 30 61 1 0 0 0 0 30 62 1 0 0 0 0 30 63 1 0 0 0 0 31 32 2 0 0 0 0 31 64 1 0 0 0 0 32 65 1 0 0 0 0 33 35 1 0 0 0 0 33 66 1 0 0 0 0 34 36 2 0 0 0 0 34 67 1 0 0 0 0 35 37 2 0 0 0 0 35 68 1 0 0 0 0 36 37 1 0 0 0 0 36 69 1 0 0 0 0 37 38 1 0 0 0 0 M END > 53383465 > 1 > 929 > 7 > 1 > 4 > AAADceB7sYAAAAAAAAAAAAAAAAAAAAAAAAA8YIEAAAAAAACBQAAAHwAQAAAADajBmBQywIPAAACoAyVyVACCAAAhAgAIiAG4dJgIYLLAkbGUIAhglgDIyAcciMCOQAAAAAAAACCAAAAAAAAAQAAAAAAAAA== > 1-(1-acetylpiperidine-4-carbonyl)-N-tert-butyl-3-[4-(trifluoromethyl)phenyl]-2H-quinoxaline-2-carboxamide > 1-[(1-acetyl-4-piperidinyl)-oxomethyl]-N-tert-butyl-3-[4-(trifluoromethyl)phenyl]-2H-quinoxaline-2-carboxamide > 1-(1-acetylpiperidine-4-carbonyl)-N-tert-butyl-3-[4-(trifluoromethyl)phenyl]-2H-quinoxaline-2-carboxamide > 1-(1-acetylpiperidine-4-carbonyl)-N-tert-butyl-3-[4-(trifluoromethyl)phenyl]-2H-quinoxaline-2-carboxamide > N-tert-butyl-1-(1-ethanoylpiperidin-4-yl)carbonyl-3-[4-(trifluoromethyl)phenyl]-2H-quinoxaline-2-carboxamide > 1-(1-acetylisonipecotoyl)-N-tert-butyl-3-[4-(trifluoromethyl)phenyl]-2H-quinoxaline-2-carboxamide > InChI=1S/C28H31F3N4O3/c1-17(36)34-15-13-19(14-16-34)26(38)35-22-8-6-5-7-21(22)32-23(24(35)25(37)33-27(2,3)4)18-9-11-20(12-10-18)28(29,30)31/h5-12,19,24H,13-16H2,1-4H3,(H,33,37) > KYJIZGLAUWLWHC-UHFFFAOYSA-N > 3.9 > 528.23482535 > C28H31F3N4O3 > 528.6 > CC(=O)N1CCC(CC1)C(=O)N2C(C(=NC3=CC=CC=C32)C4=CC=C(C=C4)C(F)(F)F)C(=O)NC(C)(C)C > CC(=O)N1CCC(CC1)C(=O)N2C(C(=NC3=CC=CC=C32)C4=CC=C(C=C4)C(F)(F)F)C(=O)NC(C)(C)C > 82.1 > 528.23482535 > 0 > 38 > 0 > 1 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 17 21 3 18 22 8 18 25 8 22 27 8 24 33 8 24 34 8 25 31 8 27 32 8 31 32 8 33 35 8 34 36 8 35 37 8 36 37 8 $$$$