10189100 -OEChem-06191314542D 78 82 0 0 0 0 0 0 0999 V2000 13.4028 -3.6396 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 9.2157 0.0206 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.9577 -3.2775 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.6119 -1.6505 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6279 0.9436 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4978 3.5277 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2086 2.3709 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2157 -1.5974 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.6279 -0.7884 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5443 0.8823 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.6803 1.8817 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5938 1.4749 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5757 2.8762 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3847 3.4640 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4028 2.0627 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2983 3.0572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8712 1.2939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9758 0.2994 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1667 -0.2884 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1667 -1.2884 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6279 -0.7884 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9758 -1.8762 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8712 -2.8707 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8893 -1.4695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1279 0.0776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1279 0.0776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.5776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.4224 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5443 -0.7271 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6983 -2.0572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6803 -3.4585 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8550 1.8329 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.9224 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.0776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5938 -3.0518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.4224 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.5776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1871 2.5772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.9224 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8532 -4.2720 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4209 -2.2383 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8299 4.2720 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1139 2.1338 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2471 0.9609 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0398 1.0442 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3039 3.4334 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9797 2.7053 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6746 1.5055 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9988 2.2336 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7314 3.9780 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9388 3.8947 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9168 3.0140 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4483 3.6588 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5994 1.8511 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2753 1.1230 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2476 -0.2579 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5717 0.4703 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3179 -1.3254 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9541 -0.8529 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7369 -1.3164 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6154 -4.0751 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4019 1.5408 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2375 2.3208 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.5424 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.6976 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 0.8876 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 -0.3855 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -1.2324 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 -1.4593 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2366 -4.2072 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7884 -4.8886 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4698 -4.3368 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0565 -2.7399 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9225 -2.6027 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7853 -1.7367 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2914 4.6860 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4159 4.7335 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3685 3.8579 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 35 1 0 0 0 0 2 19 1 0 0 0 0 2 21 1 0 0 0 0 3 23 1 0 0 0 0 3 40 1 0 0 0 0 4 30 1 0 0 0 0 4 41 1 0 0 0 0 5 26 2 0 0 0 0 6 38 1 0 0 0 0 6 42 1 0 0 0 0 7 38 2 0 0 0 0 8 20 1 0 0 0 0 8 21 2 0 0 0 0 9 21 1 0 0 0 0 9 26 1 0 0 0 0 9 58 1 0 0 0 0 10 25 1 0 0 0 0 10 27 1 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 17 1 0 0 0 0 11 43 1 0 0 0 0 12 15 1 0 0 0 0 12 44 1 0 0 0 0 12 45 1 0 0 0 0 13 14 1 0 0 0 0 13 46 1 0 0 0 0 13 47 1 0 0 0 0 14 16 1 0 0 0 0 14 50 1 0 0 0 0 14 51 1 0 0 0 0 15 16 1 0 0 0 0 15 48 1 0 0 0 0 15 49 1 0 0 0 0 16 52 1 0 0 0 0 16 53 1 0 0 0 0 17 18 1 0 0 0 0 17 54 1 0 0 0 0 17 55 1 0 0 0 0 18 19 1 0 0 0 0 18 56 1 0 0 0 0 18 57 1 0 0 0 0 19 20 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 24 2 0 0 0 0 23 31 2 0 0 0 0 24 30 1 0 0 0 0 24 59 1 0 0 0 0 25 26 1 0 0 0 0 25 29 2 0 0 0 0 27 28 2 0 0 0 0 27 34 1 0 0 0 0 28 29 1 0 0 0 0 28 33 1 0 0 0 0 29 60 1 0 0 0 0 30 35 2 0 0 0 0 31 35 1 0 0 0 0 31 61 1 0 0 0 0 32 38 1 0 0 0 0 32 62 1 0 0 0 0 32 63 1 0 0 0 0 33 36 2 0 0 0 0 33 64 1 0 0 0 0 34 37 2 0 0 0 0 34 65 1 0 0 0 0 36 37 1 0 0 0 0 36 39 1 0 0 0 0 37 66 1 0 0 0 0 39 67 1 0 0 0 0 39 68 1 0 0 0 0 39 69 1 0 0 0 0 40 70 1 0 0 0 0 40 71 1 0 0 0 0 40 72 1 0 0 0 0 41 73 1 0 0 0 0 41 74 1 0 0 0 0 41 75 1 0 0 0 0 42 76 1 0 0 0 0 42 77 1 0 0 0 0 42 78 1 0 0 0 0 M END > 10189100 > 1 > 909 > 7 > 1 > 11 > AAADcfB/OABEAAAAAAAAAAAAAAAAAWLAAAAwYMAAAAAAAFgB/AAAHgYQAAAADQ7B3iYz3/PMFAisAyXyfACC+KlnL3kJ2DW+b9iOZvPlv7uVMShuwRPY6af4yfCeDQADAQAKCAAaAAYCABQQAAAAAAAAAA== > methyl 2-[2-[[4-(4-chloro-2,5-dimethoxy-phenyl)-5-(2-cyclohexylethyl)thiazol-2-yl]carbamoyl]-5-methyl-indol-1-yl]acetate > 2-[2-[[[4-(4-chloro-2,5-dimethoxyphenyl)-5-(2-cyclohexylethyl)-2-thiazolyl]amino]-oxomethyl]-5-methyl-1-indolyl]acetic acid methyl ester > methyl 2-[2-[[4-(4-chloro-2,5-dimethoxyphenyl)-5-(2-cyclohexylethyl)-1,3-thiazol-2-yl]carbamoyl]-5-methylindol-1-yl]acetate > methyl 2-[2-[[4-(4-chloranyl-2,5-dimethoxy-phenyl)-5-(2-cyclohexylethyl)-1,3-thiazol-2-yl]carbamoyl]-5-methyl-indol-1-yl]ethanoate > 2-[2-[[4-(4-chloro-2,5-dimethoxy-phenyl)-5-(2-cyclohexylethyl)thiazol-2-yl]carbamoyl]-5-methyl-indol-1-yl]acetic acid methyl ester > InChI=1S/C32H36ClN3O5S/c1-19-10-12-24-21(14-19)15-25(36(24)18-29(37)41-4)31(38)35-32-34-30(22-16-27(40-3)23(33)17-26(22)39-2)28(42-32)13-11-20-8-6-5-7-9-20/h10,12,14-17,20H,5-9,11,13,18H2,1-4H3,(H,34,35,38) > VKJWBWCBVYASTC-UHFFFAOYSA-N > 8.5 > 609.20642 > C32H36ClN3O5S > 610.16334 > CC1=CC2=C(C=C1)N(C(=C2)C(=O)NC3=NC(=C(S3)CCC4CCCCC4)C5=CC(=C(C=C5OC)Cl)OC)CC(=O)OC > CC1=CC2=C(C=C1)N(C(=C2)C(=O)NC3=NC(=C(S3)CCC4CCCCC4)C5=CC(=C(C=C5OC)Cl)OC)CC(=O)OC > 120 > 609.20642 > 0 > 42 > 0 > 0 > 0 > 0 > 0 > 1 > 3 > 1 5 255 > 10 25 8 10 27 8 19 20 8 2 19 8 2 21 8 22 23 8 22 24 8 23 31 8 24 30 8 25 29 8 27 28 8 27 34 8 28 29 8 28 33 8 30 35 8 31 35 8 33 36 8 34 37 8 36 37 8 8 20 8 8 21 8 $$$$