70010825 -OEChem-04192413362D 69 70 0 1 0 0 0 0 0999 V2000 8.5841 5.2500 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 7.5841 6.2500 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 6.5841 5.2500 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.6200 -2.6160 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8520 -0.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9860 2.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1200 -0.7500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9860 -2.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6200 -0.8840 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8520 1.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1200 -2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1200 -1.7500 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.1200 -1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1200 -3.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1200 -2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2540 -3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1200 -1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9860 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9861 -3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9860 0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8520 -3.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7181 -3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8521 -4.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5841 -3.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7181 -5.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5841 -4.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8520 2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4501 -5.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7181 2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4501 -6.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7181 3.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5841 2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5841 4.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4501 2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4501 3.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5841 5.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5950 -1.3515 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9595 -2.3489 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5000 -3.7500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1200 -4.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7400 -3.7500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1200 -3.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7400 -2.7500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1200 -2.1300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9440 -2.7131 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7170 -3.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5640 -3.7869 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5831 -0.4400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5230 -1.9400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3755 -3.1423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7740 -3.8326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.8840 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9300 -0.3470 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7740 1.3326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3754 0.6423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3890 0.9400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7181 -2.6300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3152 -5.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1210 -3.4400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7180 -5.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0607 -5.3577 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6622 -4.6674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8301 -6.2500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4501 -6.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0701 -6.2500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1811 4.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5841 1.6300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9871 2.4400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9871 4.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 36 1 0 0 0 0 2 36 1 0 0 0 0 3 36 1 0 0 0 0 4 17 2 0 0 0 0 5 18 2 0 0 0 0 6 27 2 0 0 0 0 7 12 1 0 0 0 0 7 18 1 0 0 0 0 7 48 1 0 0 0 0 8 13 1 0 0 0 0 8 19 1 0 0 0 0 8 49 1 0 0 0 0 9 17 1 0 0 0 0 9 52 1 0 0 0 0 9 53 1 0 0 0 0 10 20 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 14 1 0 0 0 0 11 15 1 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 15 44 1 0 0 0 0 16 45 1 0 0 0 0 16 46 1 0 0 0 0 16 47 1 0 0 0 0 18 20 1 0 0 0 0 19 21 1 0 0 0 0 19 50 1 0 0 0 0 19 51 1 0 0 0 0 20 54 1 0 0 0 0 20 55 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 22 24 1 0 0 0 0 22 57 1 0 0 0 0 23 25 2 0 0 0 0 23 58 1 0 0 0 0 24 26 2 0 0 0 0 24 59 1 0 0 0 0 25 26 1 0 0 0 0 25 60 1 0 0 0 0 26 28 1 0 0 0 0 27 29 1 0 0 0 0 28 30 1 0 0 0 0 28 61 1 0 0 0 0 28 62 1 0 0 0 0 29 31 2 0 0 0 0 29 32 1 0 0 0 0 30 63 1 0 0 0 0 30 64 1 0 0 0 0 30 65 1 0 0 0 0 31 33 1 0 0 0 0 31 66 1 0 0 0 0 32 34 2 0 0 0 0 32 67 1 0 0 0 0 33 35 2 0 0 0 0 33 36 1 0 0 0 0 34 35 1 0 0 0 0 34 68 1 0 0 0 0 35 69 1 0 0 0 0 M END > 70010825 > 1 > 761 > 7 > 4 > 11 > AAADcfB7sYAAAAAAAAAAAAAAAAAAAAAAAAAwYAAAAAAAAAABQAAAHwAQAAAADojBmBQyAILAAACIAiFSEACCAAAkAAAIiIGIBMgIYDqA1TGUIQhglgCIiYcYiMCPwAACAAAAAACAAAQAAAAAAAAAAAAAAA== > N-[2-[[1-carbamoyl-1-[[(4-ethylphenyl)methylamino]methyl]-2,2-dimethyl-propyl]amino]-2-oxo-ethyl]-3-(trifluoromethyl)benzamide > N-[2-[[1-amino-2-[[(4-ethylphenyl)methylamino]methyl]-3,3-dimethyl-1-oxobutan-2-yl]amino]-2-oxoethyl]-3-(trifluoromethyl)benzamide > N-[2-[[1-amino-2-[[(4-ethylphenyl)methylamino]methyl]-3,3-dimethyl-1-oxobutan-2-yl]amino]-2-oxoethyl]-3-(trifluoromethyl)benzamide > N-[2-[[1-amino-2-[[(4-ethylphenyl)methylamino]methyl]-3,3-dimethyl-1-oxobutan-2-yl]amino]-2-oxoethyl]-3-(trifluoromethyl)benzamide > N-[2-[[1-azanyl-2-[[(4-ethylphenyl)methylamino]methyl]-3,3-dimethyl-1-oxidanylidene-butan-2-yl]amino]-2-oxidanylidene-ethyl]-3-(trifluoromethyl)benzamide > N-[2-[[1-carbamoyl-1-[[(4-ethylbenzyl)amino]methyl]-2,2-dimethyl-propyl]amino]-2-keto-ethyl]-3-(trifluoromethyl)benzamide > InChI=1S/C26H33F3N4O3/c1-5-17-9-11-18(12-10-17)14-31-16-25(23(30)36,24(2,3)4)33-21(34)15-32-22(35)19-7-6-8-20(13-19)26(27,28)29/h6-13,31H,5,14-16H2,1-4H3,(H2,30,36)(H,32,35)(H,33,34) > XQJZXYVERAIISA-UHFFFAOYSA-N > 3.8 > 506.25047541 > C26H33F3N4O3 > 506.6 > CCC1=CC=C(C=C1)CNCC(C(=O)N)(C(C)(C)C)NC(=O)CNC(=O)C2=CC(=CC=C2)C(F)(F)F > CCC1=CC=C(C=C1)CNCC(C(=O)N)(C(C)(C)C)NC(=O)CNC(=O)C2=CC(=CC=C2)C(F)(F)F > 113 > 506.25047541 > 0 > 36 > 0 > 1 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 12 13 3 21 22 8 21 23 8 22 24 8 23 25 8 24 26 8 25 26 8 29 31 8 29 32 8 31 33 8 32 34 8 33 35 8 34 35 8 $$$$