60165879 -OEChem-05112416212D 94 96 0 1 0 0 0 0 0999 V2000 10.8681 0.6200 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 10.8681 9.6200 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 12.6002 10.6200 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.8681 9.6200 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8681 9.6200 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1350 10.9525 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0010 9.4525 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2700 4.1200 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4040 2.6200 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7341 12.1200 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.8681 10.6200 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.0021 4.1200 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.6002 12.6200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4662 12.1200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6002 13.6200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3322 12.6200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4662 14.1200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3322 13.6200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7341 11.1200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8681 8.6200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4030 4.9525 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2690 5.4525 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0021 8.1200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7341 8.1200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2690 6.4525 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8681 6.6200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0021 7.1200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7341 7.1200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4030 3.9525 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5369 5.4525 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8681 5.6200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2690 8.4525 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2690 9.4525 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.1350 6.9525 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4030 6.9525 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1350 7.9525 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4030 7.9525 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0021 5.1200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4030 9.9525 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1350 9.9525 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1360 3.6200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1360 2.6200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2700 2.1200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0021 2.1200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2700 1.1200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0021 1.1200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1360 0.6200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5380 2.1200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6002 12.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0676 11.6451 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8647 11.6451 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3881 14.2026 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9896 13.5123 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5443 12.0374 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9428 12.7277 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8647 14.5949 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0676 14.5949 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9428 13.5123 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5443 14.2026 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1972 12.4300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 10.9300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9399 4.6425 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4810 4.8699 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8796 5.5601 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 8.4300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2711 8.4300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 6.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2711 6.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7830 3.9525 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4030 3.3325 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0230 3.9525 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8469 5.9894 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 5.7625 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2269 4.9155 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0802 5.0374 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4787 5.7277 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7320 9.1425 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6720 6.6425 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8660 6.6425 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6720 8.2625 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8660 8.2625 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7900 5.7026 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3915 5.0123 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7130 10.4894 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8660 10.2625 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0930 9.4155 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5390 3.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6720 11.2625 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5390 2.4300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 0.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1360 0.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2280 2.6569 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 1.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8480 1.5831 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 46 1 0 0 0 0 2 4 2 0 0 0 0 2 5 2 0 0 0 0 2 11 1 0 0 0 0 2 20 1 0 0 0 0 3 19 2 0 0 0 0 6 40 1 0 0 0 0 6 88 1 0 0 0 0 7 40 2 0 0 0 0 8 41 2 0 0 0 0 9 43 1 0 0 0 0 9 48 1 0 0 0 0 10 13 1 0 0 0 0 10 19 1 0 0 0 0 10 60 1 0 0 0 0 11 19 1 0 0 0 0 11 61 1 0 0 0 0 12 38 1 0 0 0 0 12 41 1 0 0 0 0 12 87 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 49 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 17 1 0 0 0 0 15 52 1 0 0 0 0 15 53 1 0 0 0 0 16 18 1 0 0 0 0 16 54 1 0 0 0 0 16 55 1 0 0 0 0 17 18 1 0 0 0 0 17 56 1 0 0 0 0 17 57 1 0 0 0 0 18 58 1 0 0 0 0 18 59 1 0 0 0 0 20 23 2 0 0 0 0 20 24 1 0 0 0 0 21 22 1 0 0 0 0 21 29 1 0 0 0 0 21 30 1 0 0 0 0 21 62 1 0 0 0 0 22 25 1 0 0 0 0 22 63 1 0 0 0 0 22 64 1 0 0 0 0 23 27 1 0 0 0 0 23 65 1 0 0 0 0 24 28 2 0 0 0 0 24 66 1 0 0 0 0 25 34 2 0 0 0 0 25 35 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 26 31 1 0 0 0 0 27 67 1 0 0 0 0 28 68 1 0 0 0 0 29 69 1 0 0 0 0 29 70 1 0 0 0 0 29 71 1 0 0 0 0 30 72 1 0 0 0 0 30 73 1 0 0 0 0 30 74 1 0 0 0 0 31 38 1 0 0 0 0 31 75 1 0 0 0 0 31 76 1 0 0 0 0 32 33 1 0 0 0 0 32 36 2 0 0 0 0 32 37 1 0 0 0 0 33 39 1 0 0 0 0 33 40 1 0 0 0 0 33 77 1 0 0 0 0 34 36 1 0 0 0 0 34 78 1 0 0 0 0 35 37 2 0 0 0 0 35 79 1 0 0 0 0 36 80 1 0 0 0 0 37 81 1 0 0 0 0 38 82 1 0 0 0 0 38 83 1 0 0 0 0 39 84 1 0 0 0 0 39 85 1 0 0 0 0 39 86 1 0 0 0 0 41 42 1 0 0 0 0 42 43 2 0 0 0 0 42 44 1 0 0 0 0 43 45 1 0 0 0 0 44 46 2 0 0 0 0 44 89 1 0 0 0 0 45 47 2 0 0 0 0 45 90 1 0 0 0 0 46 47 1 0 0 0 0 47 91 1 0 0 0 0 48 92 1 0 0 0 0 48 93 1 0 0 0 0 48 94 1 0 0 0 0 M END > 60165879 > 1 > 948 > 7 > 4 > 12 > AAADcfB/OABEAAAAAAAAAAAAAAAAAAAAAAAwYMGAAAAAAAABUAAAHgYQSAAADS7B2CYzD4LABgKIAiHSGHDCCBAkJQAIiJkODsiMJjaFtxuEcWhm9hOIqYeYyOCO0CAAIAAIAACgQABAABAAAAAAAAAAAA== > 5-chloro-N-[2-[4-(cyclohexylcarbamoylsulfamoyl)phenyl]ethyl]-2-methoxy-benzamide;2-(4-isobutylphenyl)propanoic acid > 5-chloro-N-[2-[4-[[(cyclohexylamino)-oxomethyl]sulfamoyl]phenyl]ethyl]-2-methoxybenzamide;2-[4-(2-methylpropyl)phenyl]propanoic acid > 5-chloro-N-[2-[4-(cyclohexylcarbamoylsulfamoyl)phenyl]ethyl]-2-methoxybenzamide;2-[4-(2-methylpropyl)phenyl]propanoic acid > 5-chloro-N-[2-[4-(cyclohexylcarbamoylsulfamoyl)phenyl]ethyl]-2-methoxybenzamide;2-[4-(2-methylpropyl)phenyl]propanoic acid > 5-chloranyl-N-[2-[4-(cyclohexylcarbamoylsulfamoyl)phenyl]ethyl]-2-methoxy-benzamide;2-[4-(2-methylpropyl)phenyl]propanoic acid > 5-chloro-N-[2-[4-(cyclohexylcarbamoylsulfamoyl)phenyl]ethyl]-2-methoxy-benzamide;2-(4-isobutylphenyl)propionic acid > InChI=1S/C23H28ClN3O5S.C13H18O2/c1-32-21-12-9-17(24)15-20(21)22(28)25-14-13-16-7-10-19(11-8-16)33(30,31)27-23(29)26-18-5-3-2-4-6-18;1-9(2)8-11-4-6-12(7-5-11)10(3)13(14)15/h7-12,15,18H,2-6,13-14H2,1H3,(H,25,28)(H2,26,27,29);4-7,9-10H,8H2,1-3H3,(H,14,15) > DELJFLGNKSKKDO-UHFFFAOYSA-N > 699.2744997 > C36H46ClN3O7S > 700.3 > CC(C)CC1=CC=C(C=C1)C(C)C(=O)O.COC1=C(C=C(C=C1)Cl)C(=O)NCCC2=CC=C(C=C2)S(=O)(=O)NC(=O)NC3CCCCC3 > CC(C)CC1=CC=C(C=C1)C(C)C(=O)O.COC1=C(C=C(C=C1)Cl)C(=O)NCCC2=CC=C(C=C2)S(=O)(=O)NC(=O)NC3CCCCC3 > 159 > 699.2744997 > 0 > 48 > 0 > 1 > 0 > 0 > 0 > 2 > -1 > 1 5 255 > 20 23 8 20 24 8 23 27 8 24 28 8 25 34 8 25 35 8 26 27 8 26 28 8 32 36 8 32 37 8 33 39 3 34 36 8 35 37 8 42 43 8 42 44 8 43 45 8 44 46 8 45 47 8 46 47 8 $$$$