METHYL 2-(ADAMANTANE-1-CARBONYLAMINO)-6-PHENYL-4,5,6,7-TETRAHYDRO-1-BENZOTHIOPHENE-3-CARBOXYLATE

pro_cas
pro_cdbregno
CCD08143390
pro_formula
C27 H31 N O3 S
pro_molWeight
449.612

basic_info

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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