9851894 -OEChem-05092414362D 76 80 0 0 0 0 0 0 0999 V2000 12.5368 3.2042 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 8.3497 -0.4559 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 11.1278 0.0396 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7097 4.0177 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7619 -1.3789 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.4871 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6318 -3.9630 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3426 -2.8062 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3497 1.1621 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7619 0.3531 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 -1.3176 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.8142 -2.3170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7097 -3.3115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7278 -1.9102 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5187 -3.8993 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5368 -2.4980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4323 -3.4926 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0052 -1.7292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1097 -0.7347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3007 -0.1469 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3007 0.8531 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7619 0.3531 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1097 1.4409 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0233 1.0342 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0052 2.4354 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2619 -0.5129 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2619 -0.5129 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.0129 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.0129 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 0.2918 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8142 3.0232 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8323 1.6219 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9889 -2.2682 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7278 2.6165 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.4871 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.5129 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.0129 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.0129 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3211 -3.0125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0414 -0.3671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7962 4.4245 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.9871 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2478 -2.5692 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1137 -3.1406 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4379 -3.8688 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1738 -1.4796 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3811 -1.3962 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0727 -4.3300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8654 -4.4133 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1328 -2.6689 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8086 -1.9408 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5823 -4.0941 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0507 -3.4493 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4092 -1.5583 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7334 -2.2864 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7057 -0.9056 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3815 -0.1774 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4519 0.8900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4388 2.6876 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8709 0.8811 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3987 1.3698 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3715 -2.7561 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5359 -1.9762 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.1329 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 0.2971 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -1.3229 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7892 -0.9335 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6078 -0.6193 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2935 0.1993 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0483 4.9909 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2297 4.6766 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5440 3.8581 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 2.5240 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 2.2971 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 1.4502 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2177 -4.4245 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 34 1 0 0 0 0 2 20 1 0 0 0 0 2 22 1 0 0 0 0 3 24 1 0 0 0 0 3 40 1 0 0 0 0 4 31 1 0 0 0 0 4 41 1 0 0 0 0 5 27 2 0 0 0 0 6 35 1 0 0 0 0 6 42 1 0 0 0 0 7 39 1 0 0 0 0 7 76 1 0 0 0 0 8 39 2 0 0 0 0 9 21 1 0 0 0 0 9 22 2 0 0 0 0 10 22 1 0 0 0 0 10 27 1 0 0 0 0 10 58 1 0 0 0 0 11 26 1 0 0 0 0 11 28 1 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 18 1 0 0 0 0 12 43 1 0 0 0 0 13 15 1 0 0 0 0 13 44 1 0 0 0 0 13 45 1 0 0 0 0 14 16 1 0 0 0 0 14 46 1 0 0 0 0 14 47 1 0 0 0 0 15 17 1 0 0 0 0 15 48 1 0 0 0 0 15 49 1 0 0 0 0 16 17 1 0 0 0 0 16 50 1 0 0 0 0 16 51 1 0 0 0 0 17 52 1 0 0 0 0 17 53 1 0 0 0 0 18 19 1 0 0 0 0 18 54 1 0 0 0 0 18 55 1 0 0 0 0 19 20 1 0 0 0 0 19 56 1 0 0 0 0 19 57 1 0 0 0 0 20 21 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 25 2 0 0 0 0 24 32 2 0 0 0 0 25 31 1 0 0 0 0 25 59 1 0 0 0 0 26 27 1 0 0 0 0 26 30 2 0 0 0 0 28 29 2 0 0 0 0 28 36 1 0 0 0 0 29 30 1 0 0 0 0 29 35 1 0 0 0 0 30 60 1 0 0 0 0 31 34 2 0 0 0 0 32 34 1 0 0 0 0 32 61 1 0 0 0 0 33 39 1 0 0 0 0 33 62 1 0 0 0 0 33 63 1 0 0 0 0 35 37 2 0 0 0 0 36 38 2 0 0 0 0 36 64 1 0 0 0 0 37 38 1 0 0 0 0 37 65 1 0 0 0 0 38 66 1 0 0 0 0 40 67 1 0 0 0 0 40 68 1 0 0 0 0 40 69 1 0 0 0 0 41 70 1 0 0 0 0 41 71 1 0 0 0 0 41 72 1 0 0 0 0 42 73 1 0 0 0 0 42 74 1 0 0 0 0 42 75 1 0 0 0 0 M END > 9851894 > 1 > 912 > 8 > 2 > 11 > AAADcfB7OABEAAAAAAAAAAAAAAAAAWLAAAAwYMAAAAAAAFgB/AAAHgYQCAAADQ7B3iYz3/PMFgisAyXyfACC+KlnL3kJ2DW+b9iOZvPlv7uUMShuwRvY6af43fPeBQABAwAKCAAKAAIGABQQAAAAAAAAAA== > 2-[2-[[4-(4-chloro-2,5-dimethoxy-phenyl)-5-(2-cyclohexylethyl)thiazol-2-yl]carbamoyl]-4-methoxy-indol-1-yl]acetic acid > 2-[2-[[[4-(4-chloro-2,5-dimethoxyphenyl)-5-(2-cyclohexylethyl)-2-thiazolyl]amino]-oxomethyl]-4-methoxy-1-indolyl]acetic acid > 2-[2-[[4-(4-chloro-2,5-dimethoxyphenyl)-5-(2-cyclohexylethyl)-1,3-thiazol-2-yl]carbamoyl]-4-methoxyindol-1-yl]acetic acid > 2-[2-[[4-(4-chloro-2,5-dimethoxyphenyl)-5-(2-cyclohexylethyl)-1,3-thiazol-2-yl]carbamoyl]-4-methoxyindol-1-yl]acetic acid > 2-[2-[[4-(4-chloranyl-2,5-dimethoxy-phenyl)-5-(2-cyclohexylethyl)-1,3-thiazol-2-yl]carbamoyl]-4-methoxy-indol-1-yl]ethanoic acid > 2-[2-[[4-(4-chloro-2,5-dimethoxy-phenyl)-5-(2-cyclohexylethyl)thiazol-2-yl]carbamoyl]-4-methoxy-indol-1-yl]acetic acid > InChI=1S/C31H34ClN3O6S/c1-39-24-11-7-10-22-19(24)14-23(35(22)17-28(36)37)30(38)34-31-33-29(20-15-26(41-3)21(32)16-25(20)40-2)27(42-31)13-12-18-8-5-4-6-9-18/h7,10-11,14-16,18H,4-6,8-9,12-13,17H2,1-3H3,(H,36,37)(H,33,34,38) > WYNBPYGACGYHSD-UHFFFAOYSA-N > 7.8 > 611.1856847 > C31H34ClN3O6S > 612.1 > COC1=CC=CC2=C1C=C(N2CC(=O)O)C(=O)NC3=NC(=C(S3)CCC4CCCCC4)C5=CC(=C(C=C5OC)Cl)OC > COC1=CC=CC2=C1C=C(N2CC(=O)O)C(=O)NC3=NC(=C(S3)CCC4CCCCC4)C5=CC(=C(C=C5OC)Cl)OC > 140 > 611.1856847 > 0 > 42 > 0 > 0 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 11 26 8 11 28 8 2 20 8 2 22 8 20 21 8 23 24 8 23 25 8 24 32 8 25 31 8 26 30 8 28 29 8 28 36 8 29 30 8 29 35 8 31 34 8 32 34 8 35 37 8 36 38 8 37 38 8 9 21 8 9 22 8 $$$$