11136112 -OEChem-04262418252D 90 94 0 0 0 0 0 0 0999 V2000 13.4028 -2.2269 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 9.2157 1.4332 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.9577 -1.8648 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4978 -3.6919 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6279 -1.1078 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.6119 -0.2379 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2366 -3.0520 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2157 -0.1848 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.6279 0.6242 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5443 -1.0466 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.6803 3.2943 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5938 2.8876 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5757 4.2888 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4028 3.4754 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3847 4.8766 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2983 4.4699 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8712 2.7065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9758 1.7120 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1667 1.1242 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1667 0.1242 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6279 0.6242 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9758 -0.4636 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.7418 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1279 -0.2418 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8712 -1.4581 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8893 -0.0568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.2582 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1279 -0.2418 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5443 0.5629 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8550 -1.9971 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.2418 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.7582 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6983 -0.6446 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6803 -2.0459 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.2582 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.7418 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5938 -1.6391 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1871 -2.7414 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4763 -3.8981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2321 -2.1079 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.7582 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4548 -4.1043 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2701 -4.8766 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6825 -2.9196 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8532 -2.8594 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4209 -0.8257 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1139 3.5465 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2471 2.3736 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0398 2.4569 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3039 4.8461 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9797 4.1179 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6746 2.9181 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9988 3.6462 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7314 5.3906 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9388 5.3073 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9168 4.4266 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4483 5.0715 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5994 3.2638 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2753 2.5356 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2476 1.1548 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5717 1.8829 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3179 1.1611 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9541 0.5598 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7369 1.1522 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2375 -2.4850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4019 -1.7050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.3782 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6154 -2.6625 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -1.0518 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6952 -1.7979 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9222 -2.6449 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7691 -2.4178 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 1.2951 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 1.0682 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 0.2213 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3269 -4.7110 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0615 -4.2322 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5826 -3.4976 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6634 -4.7488 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1422 -5.4833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8767 -5.0045 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2892 -3.0475 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8104 -2.3129 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0758 -2.7917 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2366 -2.7946 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7884 -3.4760 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4698 -2.9242 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0565 -1.3273 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9225 -1.1901 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7853 -0.3241 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 37 1 0 0 0 0 2 19 1 0 0 0 0 2 21 1 0 0 0 0 3 25 1 0 0 0 0 3 45 1 0 0 0 0 4 38 1 0 0 0 0 4 39 1 0 0 0 0 5 28 2 0 0 0 0 6 33 1 0 0 0 0 6 46 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 28 1 0 0 0 0 9 62 1 0 0 0 0 10 23 1 0 0 0 0 10 24 1 0 0 0 0 10 30 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 47 1 0 0 0 0 12 14 1 0 0 0 0 12 48 1 0 0 0 0 12 49 1 0 0 0 0 13 15 1 0 0 0 0 13 50 1 0 0 0 0 13 51 1 0 0 0 0 14 16 1 0 0 0 0 14 52 1 0 0 0 0 14 53 1 0 0 0 0 15 16 1 0 0 0 0 15 54 1 0 0 0 0 15 55 1 0 0 0 0 16 56 1 0 0 0 0 16 57 1 0 0 0 0 17 18 1 0 0 0 0 17 58 1 0 0 0 0 17 59 1 0 0 0 0 18 19 1 0 0 0 0 18 60 1 0 0 0 0 18 61 1 0 0 0 0 19 20 2 0 0 0 0 20 22 1 0 0 0 0 22 25 1 0 0 0 0 22 26 2 0 0 0 0 23 27 1 0 0 0 0 23 31 2 0 0 0 0 24 28 1 0 0 0 0 24 29 2 0 0 0 0 25 34 2 0 0 0 0 26 33 1 0 0 0 0 26 63 1 0 0 0 0 27 29 1 0 0 0 0 27 32 2 0 0 0 0 29 64 1 0 0 0 0 30 38 1 0 0 0 0 30 65 1 0 0 0 0 30 66 1 0 0 0 0 31 36 1 0 0 0 0 31 40 1 0 0 0 0 32 35 1 0 0 0 0 32 67 1 0 0 0 0 33 37 2 0 0 0 0 34 37 1 0 0 0 0 34 68 1 0 0 0 0 35 36 2 0 0 0 0 35 41 1 0 0 0 0 36 69 1 0 0 0 0 39 42 1 0 0 0 0 39 43 1 0 0 0 0 39 44 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 43 79 1 0 0 0 0 43 80 1 0 0 0 0 43 81 1 0 0 0 0 44 82 1 0 0 0 0 44 83 1 0 0 0 0 44 84 1 0 0 0 0 45 85 1 0 0 0 0 45 86 1 0 0 0 0 45 87 1 0 0 0 0 46 88 1 0 0 0 0 46 89 1 0 0 0 0 46 90 1 0 0 0 0 M END > 11136112 > 1 > 1020 > 7 > 1 > 12 > AAADcfB/OABEAAAAAAAAAAAAAAAAAWLAAAAwYMAAAAAAAFgB/AAAHgYQAAAADU7B3iYz3/PMFAisAyXyfACC+KlnL3kB2DW+b9iOZvPlv7uXMShuwRPY6af4yfCeDQADAQAKCAAaAAYCABQQAAAAAAAAAA== > tert-butyl 2-[2-[[4-(4-chloro-2,5-dimethoxy-phenyl)-5-(2-cyclohexylethyl)thiazol-2-yl]carbamoyl]-5,7-dimethyl-indol-1-yl]acetate > 2-[2-[[[4-(4-chloro-2,5-dimethoxyphenyl)-5-(2-cyclohexylethyl)-2-thiazolyl]amino]-oxomethyl]-5,7-dimethyl-1-indolyl]acetic acid tert-butyl ester > tert-butyl 2-[2-[[4-(4-chloro-2,5-dimethoxyphenyl)-5-(2-cyclohexylethyl)-1,3-thiazol-2-yl]carbamoyl]-5,7-dimethylindol-1-yl]acetate > tert-butyl 2-[2-[[4-(4-chloro-2,5-dimethoxyphenyl)-5-(2-cyclohexylethyl)-1,3-thiazol-2-yl]carbamoyl]-5,7-dimethylindol-1-yl]acetate > tert-butyl 2-[2-[[4-(4-chloranyl-2,5-dimethoxy-phenyl)-5-(2-cyclohexylethyl)-1,3-thiazol-2-yl]carbamoyl]-5,7-dimethyl-indol-1-yl]ethanoate > 2-[2-[[4-(4-chloro-2,5-dimethoxy-phenyl)-5-(2-cyclohexylethyl)thiazol-2-yl]carbamoyl]-5,7-dimethyl-indol-1-yl]acetic acid tert-butyl ester > InChI=1S/C36H44ClN3O5S/c1-21-15-22(2)33-24(16-21)17-27(40(33)20-31(41)45-36(3,4)5)34(42)39-35-38-32(25-18-29(44-7)26(37)19-28(25)43-6)30(46-35)14-13-23-11-9-8-10-12-23/h15-19,23H,8-14,20H2,1-7H3,(H,38,39,42) > YKNLYDRRHDAELE-UHFFFAOYSA-N > 9.9 > 665.2690204 > C36H44ClN3O5S > 666.3 > CC1=CC(=C2C(=C1)C=C(N2CC(=O)OC(C)(C)C)C(=O)NC3=NC(=C(S3)CCC4CCCCC4)C5=CC(=C(C=C5OC)Cl)OC)C > CC1=CC(=C2C(=C1)C=C(N2CC(=O)OC(C)(C)C)C(=O)NC3=NC(=C(S3)CCC4CCCCC4)C5=CC(=C(C=C5OC)Cl)OC)C > 120 > 665.2690204 > 0 > 46 > 0 > 0 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 10 23 8 10 24 8 19 20 8 2 19 8 2 21 8 22 25 8 22 26 8 23 27 8 23 31 8 24 29 8 25 34 8 26 33 8 27 29 8 27 32 8 31 36 8 32 35 8 33 37 8 34 37 8 35 36 8 8 20 8 8 21 8 $$$$