1-[(4aR,9aS)-3-methyl-9-(phenylsulfonyl)-4,9a-dihydro-1H-carbazol-4a-yl]-3-methyl-2-phenylsulfanyl-but-2-en-1-one

Systemtic Name: 1-[(4aR,9aS)-3-methyl-9-(phenylsulfonyl)-4,9a-dihydro-1H-carbazol-4a-yl]-3-methyl-2-phenylsulfanyl-but-2-en-1-one Openeye Name: 1-[(4aR,9aS)-9-(benzenesulfonyl)-3-methyl-4,9a-dihydro-1H-carbazol-4a-yl]-3-methyl-2-phenylsulfanyl-but-2-en-1-one CAS Name: 1-[(4aR,9aS)-9-(benzenesulfonyl)-3-methyl-4,9a-dihydro-1H-carbazol-4a-yl]-3-methyl-2-(phenylthio)-2-buten-1-one IUPAC Name: 1-[(4aR,9aS)-9-(benzenesulfonyl)-3-methyl-4,9a-dihydro-1H-carbazol-4a-yl]-3-methyl-2-phenylsulfanylbut-2-en-1-one Traditional Name: 1-[(4aR,9aS)-9-besyl-3-methyl-4,9a-dihydro-1H-carbazol-4a-yl]-3-methyl-2-(phenylthio)but-2-en-1-one Formula: C30H29NO3S2 MolecularWeight: 515.68616

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CCC2C(C1)(C3=CC=CC=C3N2S(=O)(=O)C4=CC=CC=C4)C(=O)C(=C(C)C)SC5=CC=CC=C5

Isomeric SMILES

CC1=CC[C@H]2[C@@](C1)(C3=CC=CC=C3N2S(=O)(=O)C4=CC=CC=C4)C(=O)C(=C(C)C)SC5=CC=CC=C5

InChI

InChI=1S/C30H29NO3S2/c1-21(2)28(35-23-12-6-4-7-13-23)29(32)30-20-22(3)18-19-27(30)31(26-17-11-10-16-25(26)30)36(33,34)24-14-8-5-9-15-24/h4-18,27H,19-20H2,1-3H3/t27-,30+/m0/s1