4,10b-dimethyl-8-(3-phenylisoquinolin-1-yl)sulfanyl-2,4a,5,6-tetrahydro-1H-benzo[f]quinolin-3-one

Systemtic Name: 4,10b-dimethyl-8-(3-phenylisoquinolin-1-yl)sulfanyl-2,4a,5,6-tetrahydro-1H-benzo[f]quinolin-3-one Openeye Name: 4,10b-dimethyl-8-[(3-phenyl-1-isoquinolyl)sulfanyl]-2,4a,5,6-tetrahydro-1H-benzo[f]quinolin-3-one CAS Name: 4,10b-dimethyl-8-[(3-phenyl-1-isoquinolinyl)thio]-2,4a,5,6-tetrahydro-1H-benzo[f]quinolin-3-one IUPAC Name: 4,10b-dimethyl-8-(3-phenylisoquinolin-1-yl)sulfanyl-2,4a,5,6-tetrahydro-1H-benzo[f]quinolin-3-one Traditional Name: 4,10b-dimethyl-8-[(3-phenyl-1-isoquinolyl)thio]-2,4a,5,6-tetrahydro-1H-benzo[f]quinolin-3-one Formula: C30H28N2OS MolecularWeight: 464.62112

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Descriptors Computed from Structure

Canonical SMILES:

CC12CCC(=O)N(C1CCC3=C2C=CC(=C3)SC4=NC(=CC5=CC=CC=C54)C6=CC=CC=C6)C

Isomeric SMILES

CC12CCC(=O)N(C1CCC3=C2C=CC(=C3)SC4=NC(=CC5=CC=CC=C54)C6=CC=CC=C6)C

InChI

InChI=1S/C30H28N2OS/c1-30-17-16-28(33)32(2)27(30)15-12-22-18-23(13-14-25(22)30)34-29-24-11-7-6-10-21(24)19-26(31-29)20-8-4-3-5-9-20/h3-11,13-14,18-19,27H,12,15-17H2,1-2H3