56588246 -OEChem-05132408522D 61 65 0 0 0 0 0 0 0999 V2000 10.9167 -2.6735 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 9.8161 -3.5616 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 8.9280 -2.4610 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 7.9244 -1.4024 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2435 1.7779 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5701 1.9105 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2781 -0.8643 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 -4.5810 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9809 1.1042 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.5189 0.5998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9889 -2.0210 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 -2.9715 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5673 0.2925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9674 -1.8148 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.2763 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5206 1.5998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9809 1.1025 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3269 0.0107 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -4.2763 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2566 -0.6581 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2619 -3.7763 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.7763 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3306 2.1862 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2206 -0.9837 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -4.7763 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2411 0.4158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0286 -1.5729 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.2763 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2278 3.1809 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -4.2763 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0491 -0.1734 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9429 -1.1677 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9224 -2.5672 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0378 3.7673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3150 3.5892 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9350 4.7620 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2122 4.5839 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0222 5.1703 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9684 -1.4014 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3751 -1.9337 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9880 -2.4344 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5812 -1.9021 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3795 2.5005 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8640 -0.4028 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8819 -3.7763 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8709 -5.1703 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.1563 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6538 -1.2349 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3070 1.0323 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -5.3963 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -2.9663 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6718 1.6417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6700 0.5678 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -4.5863 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6159 0.0778 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4438 -1.5330 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6038 3.5142 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8128 3.2257 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4373 5.1256 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6462 4.8371 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9585 5.7870 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 33 1 0 0 0 0 2 33 1 0 0 0 0 3 33 1 0 0 0 0 4 20 2 0 0 0 0 5 23 2 0 0 0 0 6 16 1 0 0 0 0 6 17 1 0 0 0 0 6 43 1 0 0 0 0 7 14 1 0 0 0 0 7 20 1 0 0 0 0 7 44 1 0 0 0 0 8 19 1 0 0 0 0 8 21 1 0 0 0 0 8 46 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 13 1 0 0 0 0 10 16 2 0 0 0 0 10 18 1 0 0 0 0 11 12 1 0 0 0 0 11 14 1 0 0 0 0 11 39 1 0 0 0 0 11 40 1 0 0 0 0 12 15 1 0 0 0 0 12 21 2 0 0 0 0 13 17 2 0 0 0 0 13 20 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 15 19 1 0 0 0 0 15 22 2 0 0 0 0 16 23 1 0 0 0 0 18 24 2 0 0 0 0 18 26 1 0 0 0 0 19 25 2 0 0 0 0 21 45 1 0 0 0 0 22 28 1 0 0 0 0 22 47 1 0 0 0 0 23 29 1 0 0 0 0 24 27 1 0 0 0 0 24 48 1 0 0 0 0 25 30 1 0 0 0 0 25 50 1 0 0 0 0 26 31 2 0 0 0 0 26 49 1 0 0 0 0 27 32 2 0 0 0 0 27 33 1 0 0 0 0 28 30 2 0 0 0 0 28 51 1 0 0 0 0 29 34 2 0 0 0 0 29 35 1 0 0 0 0 30 54 1 0 0 0 0 31 32 1 0 0 0 0 31 55 1 0 0 0 0 32 56 1 0 0 0 0 34 36 1 0 0 0 0 34 57 1 0 0 0 0 35 37 2 0 0 0 0 35 58 1 0 0 0 0 36 38 2 0 0 0 0 36 59 1 0 0 0 0 37 38 1 0 0 0 0 37 60 1 0 0 0 0 38 61 1 0 0 0 0 M END > 56588246 > 1 > 833 > 6 > 4 > 7 > AAADceB7sYAAAAAAAAAAAAAAAAAAAWLAAAAwYMAAAAAAAFgB/AAAHwAQAAAADAzBnhQ98PLJkACoA7d3dACCgCm3AiAI2aG4ZNiIIPrA1bGEIYhglgLIyecci8CugAACAAACAAAAAAQAAAQAAAAAAAAAAA== > 2-amino-5-benzoyl-N-[2-(1H-indol-3-yl)ethyl]-4-[3-(trifluoromethyl)phenyl]-1H-pyrrole-3-carboxamide > 2-amino-5-benzoyl-N-[2-(1H-indol-3-yl)ethyl]-4-[3-(trifluoromethyl)phenyl]-1H-pyrrole-3-carboxamide > 2-amino-5-benzoyl-N-[2-(1H-indol-3-yl)ethyl]-4-[3-(trifluoromethyl)phenyl]-1H-pyrrole-3-carboxamide > 2-amino-5-benzoyl-N-[2-(1H-indol-3-yl)ethyl]-4-[3-(trifluoromethyl)phenyl]-1H-pyrrole-3-carboxamide > 2-azanyl-N-[2-(1H-indol-3-yl)ethyl]-5-(phenylcarbonyl)-4-[3-(trifluoromethyl)phenyl]-1H-pyrrole-3-carboxamide > 2-amino-5-benzoyl-N-[2-(1H-indol-3-yl)ethyl]-4-[3-(trifluoromethyl)phenyl]-1H-pyrrole-3-carboxamide > InChI=1S/C29H23F3N4O2/c30-29(31,32)20-10-6-9-18(15-20)23-24(27(33)36-25(23)26(37)17-7-2-1-3-8-17)28(38)34-14-13-19-16-35-22-12-5-4-11-21(19)22/h1-12,15-16,35-36H,13-14,33H2,(H,34,38) > CXHJLXMDNOSDLX-UHFFFAOYSA-N > 6.5 > 516.17731048 > C29H23F3N4O2 > 516.5 > C1=CC=C(C=C1)C(=O)C2=C(C(=C(N2)N)C(=O)NCCC3=CNC4=CC=CC=C43)C5=CC(=CC=C5)C(F)(F)F > C1=CC=C(C=C1)C(=O)C2=C(C(=C(N2)N)C(=O)NCCC3=CNC4=CC=CC=C43)C5=CC(=CC=C5)C(F)(F)F > 104 > 516.17731048 > 0 > 38 > 0 > 0 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 10 13 8 10 16 8 12 15 8 12 21 8 13 17 8 15 19 8 15 22 8 18 24 8 18 26 8 19 25 8 22 28 8 24 27 8 25 30 8 26 31 8 27 32 8 28 30 8 29 34 8 29 35 8 31 32 8 34 36 8 35 37 8 36 38 8 37 38 8 6 16 8 6 17 8 8 19 8 8 21 8 $$$$