1933154 -OEChem-03282407162D 46 48 0 0 0 0 0 0 0999 V2000 5.1408 -1.6088 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.7290 -2.5282 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.7672 1.6937 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4162 1.1638 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3208 -3.3193 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2334 -3.3867 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7204 -0.7962 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2247 -1.6547 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4294 0.0834 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.8197 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4032 0.3108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4384 -1.7185 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1881 -0.3088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4144 -1.9361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1931 -1.3088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1328 0.0007 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7204 -0.8011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4387 0.9527 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2247 -1.6597 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0731 2.6458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4016 3.3867 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7290 -2.5182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7290 -2.5132 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3128 -1.7013 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2653 -2.0056 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2703 -3.0055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4263 0.7034 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8242 0.2184 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5133 -0.4355 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5172 -1.2087 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8860 0.6998 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1314 0.8681 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8346 -1.8595 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4415 -2.3385 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1482 -2.4961 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9010 -2.3203 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0277 -0.2577 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6215 2.3565 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4532 3.1356 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5320 -1.1162 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8610 3.8031 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9852 3.8461 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9422 2.9704 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1182 -1.1126 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7651 -1.6386 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7737 -3.3675 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 15 1 0 0 0 0 1 17 1 0 0 0 0 2 19 2 0 0 0 0 3 18 1 0 0 0 0 3 20 1 0 0 0 0 4 18 2 0 0 0 0 5 23 1 0 0 0 0 5 26 1 0 0 0 0 6 22 2 0 0 0 0 7 17 1 0 0 0 0 7 19 1 0 0 0 0 7 37 1 0 0 0 0 8 19 1 0 0 0 0 8 22 1 0 0 0 0 8 40 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 27 1 0 0 0 0 9 28 1 0 0 0 0 10 12 1 0 0 0 0 10 29 1 0 0 0 0 10 30 1 0 0 0 0 11 13 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 12 14 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 13 15 2 0 0 0 0 13 16 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 20 39 1 0 0 0 0 21 41 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 24 25 1 0 0 0 0 24 44 1 0 0 0 0 25 26 2 0 0 0 0 25 45 1 0 0 0 0 26 46 1 0 0 0 0 M END > 1933154 > 1 > 545 > 6 > 2 > 5 > AAADceB7OABgAAAAAAAAAAAAAAAAASJAAAAAAAAABgAAAACR4AAAHgQQAAAADASh2AIzjYLABEiMAqnS2AKDCIBlKBkIiBHGTMiOJjrktb+HGajuwRN46eeY3+KOgAAAAAAAAAAAAAAAAAAAAAAAAAAAAA== > ethyl 2-(furan-2-carbonylcarbamothioylamino)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate > 2-[[[[2-furanyl(oxo)methyl]amino]-sulfanylidenemethyl]amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylic acid ethyl ester > ethyl 2-(furan-2-carbonylcarbamothioylamino)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate > ethyl 2-(furan-2-carbonylcarbamothioylamino)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate > ethyl 2-(furan-2-ylcarbonylcarbamothioylamino)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate > 2-(2-furoylthiocarbamoylamino)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylic acid ethyl ester > InChI=1S/C18H20N2O4S2/c1-2-23-17(22)14-11-7-4-3-5-9-13(11)26-16(14)20-18(25)19-15(21)12-8-6-10-24-12/h6,8,10H,2-5,7,9H2,1H3,(H2,19,20,21,25) > MJJMNIIPKQGPMH-UHFFFAOYSA-N > 4.9 > 392.08644947 > C18H20N2O4S2 > 392.5 > CCOC(=O)C1=C(SC2=C1CCCCC2)NC(=S)NC(=O)C3=CC=CO3 > CCOC(=O)C1=C(SC2=C1CCCCC2)NC(=S)NC(=O)C3=CC=CO3 > 141 > 392.08644947 > 0 > 26 > 0 > 0 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 1 15 8 1 17 8 13 15 8 13 16 8 16 17 8 23 24 8 24 25 8 25 26 8 5 23 8 5 26 8 $$$$