23684412 -OEChem-04262400092D 78 81 0 1 0 0 0 0 0999 V2000 7.7526 4.2514 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.3669 0.0000 0.0000 Na 0 3 0 0 0 0 0 0 0 0 0 0 6.1648 3.3284 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0347 0.7443 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 2.7455 1.9010 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5308 4.7469 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1127 8.7250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0812 3.3896 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1648 5.0604 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7526 5.8694 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5880 12.6888 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.5880 13.6888 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.4545 13.1888 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6369 12.3798 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6369 13.9978 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0491 13.1888 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1350 3.6944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6648 4.1944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1350 4.6944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0812 4.9991 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3919 2.4391 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2690 5.1944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6648 4.1944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2690 3.1944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4030 4.6944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4030 3.6944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6648 5.9264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1648 5.0604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5369 5.1944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7240 1.6948 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1648 6.7924 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7037 5.5604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5127 6.1482 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7037 4.5604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4262 5.7415 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4082 7.1427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1307 7.3238 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2172 7.7305 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2353 6.3292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9398 7.9115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4443 4.3402 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9217 9.3128 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8401 12.1224 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8401 14.2552 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8530 12.7138 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8530 13.6638 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1000 12.0698 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8891 11.8134 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8891 14.5642 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1000 14.3078 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5884 13.6037 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5884 12.7739 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2738 5.5884 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7744 1.9512 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9388 2.7311 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2690 5.8144 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2690 2.5744 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8660 3.3844 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1899 6.3250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1899 5.5279 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8469 5.7313 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 5.5044 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2269 4.6574 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7018 6.4824 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4748 7.3294 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6279 7.1024 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2053 4.1960 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8418 7.3949 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8017 6.0771 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3042 7.4100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4413 8.2760 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5753 8.4131 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1921 3.7738 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0107 4.0880 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6965 4.9066 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2861 8.8112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4233 9.6772 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5573 9.8144 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 28 1 0 0 0 0 1 34 1 0 0 0 0 3 23 2 0 0 0 0 4 30 1 0 0 0 0 5 30 2 0 0 0 0 6 35 1 0 0 0 0 6 41 1 0 0 0 0 7 38 1 0 0 0 0 7 42 1 0 0 0 0 8 17 1 0 0 0 0 8 18 1 0 0 0 0 8 21 1 0 0 0 0 9 23 1 0 0 0 0 9 27 1 0 0 0 0 9 28 1 0 0 0 0 10 28 2 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 14 1 0 0 0 0 11 43 1 0 0 0 0 12 13 1 0 0 0 0 12 15 1 0 0 0 0 12 44 1 0 0 0 0 13 45 1 0 0 0 0 13 46 1 0 0 0 0 14 16 1 0 0 0 0 14 47 1 0 0 0 0 14 48 1 0 0 0 0 15 16 1 0 0 0 0 15 49 1 0 0 0 0 15 50 1 0 0 0 0 16 51 1 0 0 0 0 16 52 1 0 0 0 0 17 19 2 0 0 0 0 17 24 1 0 0 0 0 18 20 2 0 0 0 0 18 23 1 0 0 0 0 19 20 1 0 0 0 0 19 22 1 0 0 0 0 20 53 1 0 0 0 0 21 30 1 0 0 0 0 21 54 1 0 0 0 0 21 55 1 0 0 0 0 22 25 2 0 0 0 0 22 56 1 0 0 0 0 24 26 2 0 0 0 0 24 57 1 0 0 0 0 25 26 1 0 0 0 0 25 29 1 0 0 0 0 26 58 1 0 0 0 0 27 31 1 0 0 0 0 27 59 1 0 0 0 0 27 60 1 0 0 0 0 29 61 1 0 0 0 0 29 62 1 0 0 0 0 29 63 1 0 0 0 0 31 64 1 0 0 0 0 31 65 1 0 0 0 0 31 66 1 0 0 0 0 32 33 1 0 0 0 0 32 34 2 0 0 0 0 33 35 2 0 0 0 0 33 36 1 0 0 0 0 34 67 1 0 0 0 0 35 39 1 0 0 0 0 36 38 2 0 0 0 0 36 68 1 0 0 0 0 37 38 1 0 0 0 0 37 39 2 0 0 0 0 37 40 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 CHG 2 2 1 4 -1 M END > 23684412 > 1 > 822 > 7 > 0 > 8 > AAADcfB/OCBAAAAAAAAAAAAAGAAAAeLEAAAwYMAAAAAAAFgB/AAAHgQAAAAADQzF3gaz3/MMFAisAyXyfACC+KlnKjgJ2DW+bNiOZvLkvbuUMShuxxPY6af4yfCeSQADAAAKAACSAAYAABQAAAAAAAAAAA== > sodium;bicyclo[3.1.0]hexane;2-[2-[[4-(2,5-dimethoxy-4-methyl-phenyl)thiazol-2-yl]-ethyl-carbamoyl]-5-methyl-indol-1-yl]acetate > sodium;bicyclo[3.1.0]hexane;2-[2-[[[4-(2,5-dimethoxy-4-methylphenyl)-2-thiazolyl]-ethylamino]-oxomethyl]-5-methyl-1-indolyl]acetate > sodium;bicyclo[3.1.0]hexane;2-[2-[[4-(2,5-dimethoxy-4-methylphenyl)-1,3-thiazol-2-yl]-ethylcarbamoyl]-5-methylindol-1-yl]acetate > sodium;bicyclo[3.1.0]hexane;2-[2-[[4-(2,5-dimethoxy-4-methylphenyl)-1,3-thiazol-2-yl]-ethylcarbamoyl]-5-methylindol-1-yl]acetate > sodium;bicyclo[3.1.0]hexane;2-[2-[[4-(2,5-dimethoxy-4-methyl-phenyl)-1,3-thiazol-2-yl]-ethyl-carbamoyl]-5-methyl-indol-1-yl]ethanoate > sodium;bicyclo[3.1.0]hexane;2-[2-[[4-(2,5-dimethoxy-4-methyl-phenyl)thiazol-2-yl]-ethyl-carbamoyl]-5-methyl-indol-1-yl]acetate > InChI=1S/C26H27N3O5S.C6H10.Na/c1-6-28(25(32)21-11-17-9-15(2)7-8-20(17)29(21)13-24(30)31)26-27-19(14-35-26)18-12-22(33-4)16(3)10-23(18)34-5;1-2-5-4-6(5)3-1;/h7-12,14H,6,13H2,1-5H3,(H,30,31);5-6H,1-4H2;/q;;+1/p-1 > HKFVMLLHGQBHAB-UHFFFAOYSA-M > 597.22733671 > C32H36N3NaO5S > 597.7 > CCN(C1=NC(=CS1)C2=C(C=C(C(=C2)OC)C)OC)C(=O)C3=CC4=C(N3CC(=O)[O-])C=CC(=C4)C.C1CC2CC2C1.[Na+] > CCN(C1=NC(=CS1)C2=C(C=C(C(=C2)OC)C)OC)C(=O)C3=CC4=C(N3CC(=O)[O-])C=CC(=C4)C.C1CC2CC2C1.[Na+] > 125 > 597.22733671 > 0 > 42 > 0 > 2 > 0 > 0 > 0 > 3 > -1 > 2 4 7 > 1 5 255 > 1 28 8 1 34 8 10 28 8 10 32 8 11 14 3 12 15 3 17 19 8 17 24 8 18 20 8 19 20 8 19 22 8 22 25 8 24 26 8 25 26 8 32 34 8 33 35 8 33 36 8 35 39 8 36 38 8 37 38 8 37 39 8 8 17 8 8 18 8 $$$$