2,3-dimethoxy-N-(3-methylsulfanylphenyl)-8-oxidanylidene-5,6,13,13a-tetrahydroisoquinolino[2,1-b]isoquinoline-13-carboxamide

Systemtic Name: 2,3-dimethoxy-N-(3-methylsulfanylphenyl)-8-oxidanylidene-5,6,13,13a-tetrahydroisoquinolino[2,1-b]isoquinoline-13-carboxamide Openeye Name: 2,3-dimethoxy-N-(3-methylsulfanylphenyl)-8-oxo-5,6,13,13a-tetrahydroisoquinolino[2,1-b]isoquinoline-13-carboxamide CAS Name: 2,3-dimethoxy-N-[3-(methylthio)phenyl]-8-oxo-5,6,13,13a-tetrahydroisoquinolino[2,1-b]isoquinoline-13-carboxamide IUPAC Name: 2,3-dimethoxy-N-(3-methylsulfanylphenyl)-8-oxo-5,6,13,13a-tetrahydroisoquinolino[2,1-b]isoquinoline-13-carboxamide Traditional Name: 8-keto-2,3-dimethoxy-N-[3-(methylthio)phenyl]-5,6,13,13a-tetrahydroisoquinolin[2,1-b]isoquinoline-13-carboxamide Formula: C27H26N2O4S MolecularWeight: 474.57134

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C3C(C4=CC=CC=C4C(=O)N3CCC2=C1)C(=O)NC5=CC(=CC=C5)SC)OC

Isomeric SMILES

COC1=C(C=C2C3C(C4=CC=CC=C4C(=O)N3CCC2=C1)C(=O)NC5=CC(=CC=C5)SC)OC

InChI

InChI=1S/C27H26N2O4S/c1-32-22-13-16-11-12-29-25(21(16)15-23(22)33-2)24(19-9-4-5-10-20(19)27(29)31)26(30)28-17-7-6-8-18(14-17)34-3/h4-10,13-15,24-25H,11-12H2,1-3H3,(H,28,30)