69992931 -OEChem-04162407482D 63 64 0 1 0 0 0 0 0999 V2000 8.9641 4.0600 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 9.9641 5.0600 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 10.9641 4.0600 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 7.3660 -4.4400 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2320 -1.9400 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3660 1.5600 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5000 -1.9400 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0000 -2.0740 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6340 -4.4400 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2320 0.0600 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5000 -2.9400 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.5000 -2.9400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5000 -2.9400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5000 -3.9400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0000 -3.8060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0000 -2.0740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3660 -1.4400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5000 -1.2080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3660 -0.4400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0000 -0.3419 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5000 -1.2080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5000 0.5241 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5000 0.5241 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.3419 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0000 -0.3419 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.3901 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2320 1.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0981 1.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0981 2.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9641 1.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9641 3.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8301 1.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8301 2.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9641 4.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9174 -3.1520 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6077 -3.5506 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0826 -2.7280 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3923 -2.3294 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9631 -1.6300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3100 -1.5370 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4631 -4.1160 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3100 -4.3430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5369 -3.4960 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4174 -2.2860 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1077 -2.6846 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1540 0.1426 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7554 -0.5477 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6340 -5.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0970 -4.1300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1900 -1.7449 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8100 1.0610 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3800 -0.3419 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0000 -0.9619 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6200 -0.3419 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0000 0.2781 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7690 -0.2500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 1.7001 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 1.9271 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 1.0801 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5611 2.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9641 0.4400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3671 1.2500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3671 2.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 34 1 0 0 0 0 2 34 1 0 0 0 0 3 34 1 0 0 0 0 4 14 2 0 0 0 0 5 17 2 0 0 0 0 6 27 2 0 0 0 0 7 11 1 0 0 0 0 7 17 1 0 0 0 0 7 39 1 0 0 0 0 8 12 1 0 0 0 0 8 16 1 0 0 0 0 8 40 1 0 0 0 0 9 14 1 0 0 0 0 9 48 1 0 0 0 0 9 49 1 0 0 0 0 10 19 1 0 0 0 0 10 27 1 0 0 0 0 10 56 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 14 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 13 15 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 16 18 1 0 0 0 0 16 44 1 0 0 0 0 16 45 1 0 0 0 0 17 19 1 0 0 0 0 18 20 2 0 0 0 0 18 21 1 0 0 0 0 19 46 1 0 0 0 0 19 47 1 0 0 0 0 20 22 1 0 0 0 0 20 25 1 0 0 0 0 21 24 2 0 0 0 0 21 50 1 0 0 0 0 22 23 2 0 0 0 0 22 51 1 0 0 0 0 23 24 1 0 0 0 0 23 26 1 0 0 0 0 24 52 1 0 0 0 0 25 53 1 0 0 0 0 25 54 1 0 0 0 0 25 55 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 28 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 29 31 1 0 0 0 0 29 60 1 0 0 0 0 30 32 2 0 0 0 0 30 61 1 0 0 0 0 31 33 2 0 0 0 0 31 34 1 0 0 0 0 32 33 1 0 0 0 0 32 62 1 0 0 0 0 33 63 1 0 0 0 0 M END > 69992931 > 1 > 718 > 7 > 4 > 10 > AAADceB7sYAAAAAAAAAAAAAAAAAAAAAAAAAwYAAAAAAAAAABQAAAHwAQAAAADIjBmBQyAILAAACIAiFSEACCAAAkAAAIiIGIBMgIYDqA1TGUIQhglgCIiYcYiMCOwAACAAAQAACAAAQAACAAAAAAAAAAAA== > N-[2-[[1-carbamoyl-1-[[(2,4-dimethylphenyl)methylamino]methyl]propyl]amino]-2-oxo-ethyl]-3-(trifluoromethyl)benzamide > N-[2-[[1-amino-2-[[(2,4-dimethylphenyl)methylamino]methyl]-1-oxobutan-2-yl]amino]-2-oxoethyl]-3-(trifluoromethyl)benzamide > N-[2-[[1-amino-2-[[(2,4-dimethylphenyl)methylamino]methyl]-1-oxobutan-2-yl]amino]-2-oxoethyl]-3-(trifluoromethyl)benzamide > N-[2-[[1-amino-2-[[(2,4-dimethylphenyl)methylamino]methyl]-1-oxobutan-2-yl]amino]-2-oxoethyl]-3-(trifluoromethyl)benzamide > N-[2-[[1-azanyl-2-[[(2,4-dimethylphenyl)methylamino]methyl]-1-oxidanylidene-butan-2-yl]amino]-2-oxidanylidene-ethyl]-3-(trifluoromethyl)benzamide > N-[2-[[1-carbamoyl-1-[[(2,4-dimethylbenzyl)amino]methyl]propyl]amino]-2-keto-ethyl]-3-(trifluoromethyl)benzamide > InChI=1S/C24H29F3N4O3/c1-4-23(22(28)34,14-29-12-18-9-8-15(2)10-16(18)3)31-20(32)13-30-21(33)17-6-5-7-19(11-17)24(25,26)27/h5-11,29H,4,12-14H2,1-3H3,(H2,28,34)(H,30,33)(H,31,32) > VSHPKTCPENWJED-UHFFFAOYSA-N > 2.9 > 478.21917529 > C24H29F3N4O3 > 478.5 > CCC(CNCC1=C(C=C(C=C1)C)C)(C(=O)N)NC(=O)CNC(=O)C2=CC(=CC=C2)C(F)(F)F > CCC(CNCC1=C(C=C(C=C1)C)C)(C(=O)N)NC(=O)CNC(=O)C2=CC(=CC=C2)C(F)(F)F > 113 > 478.21917529 > 0 > 34 > 0 > 1 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 11 13 3 18 20 8 18 21 8 20 22 8 21 24 8 22 23 8 23 24 8 28 29 8 28 30 8 29 31 8 30 32 8 31 33 8 32 33 8 $$$$