basic_info |
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| Product_Name: | METHYL 2-(ADAMANTANE-1-CARBONYLAMINO)-6-PHENYL-4,5,6,7-TETRAHYDRO-1-BENZOTHIOPHENE-3-CARBOXYLATE |
| EnglishSynonyms: | METHYL 2-(ADAMANTANE-1-CARBONYLAMINO)-6-PHENYL-4,5,6,7-TETRAHYDRO-1-BENZOTHIOPHENE-3-CARBOXYLATE |
| pro_mdlNumber: | MFCD02243089 |
| pro_acceptors: | 4 |
| pro_donors: | 1 |
| pro_smile: | COC(=O)c1c2c(sc1NC(=O)[C@]34C[C@@H]5C[C@H](C3)C[C@@H](C5)C4)CC(CC2)c6ccccc6 |
| InChi: | InChI=1S/C27H31NO3S/c1-31-25(29)23-21-8-7-20(19-5-3-2-4-6-19)12-22(21)32-24(23)28-26(30)27-13-16-9-17(14-27)11-18(10-16)15-27/h2-6,16-18,20H,7-15H2,1H3,(H,28,30)/t16-,17+,18-,20?,27- |
| InChiKey: | InChIKey=DNMKIBDYUVILJU-BJHVAVSMSA-N |
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