23033472 -OEChem-05231314452D 65 68 0 0 0 0 0 0 0999 V2000 3.1436 10.8094 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 5.1549 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 4.8061 10.1679 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 10.0297 6.5991 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9333 9.7119 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5358 5.2331 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4018 3.7331 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5297 2.2690 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.0297 4.8671 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.9461 6.5378 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7985 9.2104 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.5297 4.0010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5297 4.0010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0297 3.1350 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5297 2.2690 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0297 3.1350 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0297 1.4030 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5297 0.5369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0297 1.4030 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5297 5.7331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5297 5.7331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9998 6.2331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9461 4.9284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9998 5.2331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2567 7.4883 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1338 6.7331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1338 4.7331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5889 8.2326 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2678 5.2331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2678 6.2331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5942 8.1298 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1890 9.0441 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4018 4.7331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2112 9.2537 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4670 8.5858 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6018 9.0873 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8114 10.0651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1497 4.0010 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5046 2.7365 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5046 3.5335 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6373 4.6116 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9471 4.2131 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4220 1.6584 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1123 2.0569 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5547 3.5335 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5547 2.7365 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7197 1.9399 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6497 4.8671 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9928 0.2269 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8397 0.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0666 0.8469 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0297 2.0230 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4097 1.4030 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0297 0.7830 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1387 4.3390 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8037 7.1963 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6393 7.9762 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1338 7.3531 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1338 4.1131 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7309 6.5431 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2833 7.5934 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5307 7.9691 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9988 4.9231 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0349 8.8362 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0000 5.1549 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 37 1 0 0 0 0 2 65 1 0 0 0 0 3 34 1 0 0 0 0 3 37 1 0 0 0 0 4 20 2 0 0 0 0 5 11 1 0 0 0 0 5 32 1 0 0 0 0 6 33 1 0 0 0 0 6 63 1 0 0 0 0 7 33 2 0 0 0 0 8 15 1 0 0 0 0 8 16 1 0 0 0 0 8 17 1 0 0 0 0 9 12 1 0 0 0 0 9 20 1 0 0 0 0 9 48 1 0 0 0 0 10 21 1 0 0 0 0 10 22 1 0 0 0 0 10 25 1 0 0 0 0 11 28 2 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 38 1 0 0 0 0 13 16 1 0 0 0 0 13 41 1 0 0 0 0 13 42 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 14 40 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 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 47 1 0 0 0 0 18 49 1 0 0 0 0 18 50 1 0 0 0 0 18 51 1 0 0 0 0 19 52 1 0 0 0 0 19 53 1 0 0 0 0 19 54 1 0 0 0 0 20 21 1 0 0 0 0 21 23 2 0 0 0 0 22 24 2 0 0 0 0 22 26 1 0 0 0 0 23 24 1 0 0 0 0 23 55 1 0 0 0 0 24 27 1 0 0 0 0 25 28 1 0 0 0 0 25 56 1 0 0 0 0 25 57 1 0 0 0 0 26 30 2 0 0 0 0 26 58 1 0 0 0 0 27 29 2 0 0 0 0 27 59 1 0 0 0 0 28 31 1 0 0 0 0 29 30 1 0 0 0 0 29 33 1 0 0 0 0 30 60 1 0 0 0 0 31 32 2 0 0 0 0 31 61 1 0 0 0 0 32 34 1 0 0 0 0 34 35 2 0 0 0 0 35 36 1 0 0 0 0 35 62 1 0 0 0 0 36 37 2 0 0 0 0 36 64 1 0 0 0 0 M END > 23033472 > 1 > 798 > 7 > 3 > 7 > AAADceB7uABGAAAAAAAAAAAAAAAAAWLEgAA8QAAAAAAAAFgB/gAAHgYUCAAADC7B3iQyzfPcEgitA6XyXgCDgKAnLzBo2Lm+btoIZvrh17OUcYhm1hno2ce82eOeCAACAAACAAAQAAQAAAQAAAAAAAAAAA== > 1-[[5-(5-chloro-2-thienyl)isoxazol-3-yl]methyl]-2-[(1-isopropyl-4-piperidyl)carbamoyl]indole-5-carboxylic acid;hydrochloride > 1-[[5-(5-chloro-2-thiophenyl)-3-isoxazolyl]methyl]-2-[oxo-[(1-propan-2-yl-4-piperidinyl)amino]methyl]-5-indolecarboxylic acid;hydrochloride > 1-[[5-(5-chlorothiophen-2-yl)-1,2-oxazol-3-yl]methyl]-2-[(1-propan-2-ylpiperidin-4-yl)carbamoyl]indole-5-carboxylic acid;hydrochloride > 1-[[5-(5-chloranylthiophen-2-yl)-1,2-oxazol-3-yl]methyl]-2-[(1-propan-2-ylpiperidin-4-yl)carbamoyl]indole-5-carboxylic acid;hydrochloride > 1-[[5-(5-chloro-2-thienyl)isoxazol-3-yl]methyl]-2-[(1-isopropyl-4-piperidyl)carbamoyl]indole-5-carboxylic acid;hydrochloride > InChI=1S/C26H27ClN4O4S.ClH/c1-15(2)30-9-7-18(8-10-30)28-25(32)21-12-17-11-16(26(33)34)3-4-20(17)31(21)14-19-13-22(35-29-19)23-5-6-24(27)36-23;/h3-6,11-13,15,18H,7-10,14H2,1-2H3,(H,28,32)(H,33,34);1H > GUMKAVRTBVRFND-UHFFFAOYSA-N > 562.120832 > C26H28Cl2N4O4S > 563.49592 > CC(C)N1CCC(CC1)NC(=O)C2=CC3=C(N2CC4=NOC(=C4)C5=CC=C(S5)Cl)C=CC(=C3)C(=O)O.Cl > CC(C)N1CCC(CC1)NC(=O)C2=CC3=C(N2CC4=NOC(=C4)C5=CC=C(S5)Cl)C=CC(=C3)C(=O)O.Cl > 129 > 562.120832 > 0 > 37 > 0 > 0 > 0 > 0 > 0 > 2 > 2 > 1 5 255 > 10 21 8 10 22 8 11 28 8 21 23 8 22 24 8 22 26 8 23 24 8 24 27 8 26 30 8 27 29 8 28 31 8 29 30 8 3 34 8 3 37 8 31 32 8 34 35 8 35 36 8 36 37 8 5 11 8 5 32 8 $$$$