N-(3-chloranyl-4-methoxy-phenyl)-6,7-dimethoxy-2-methyl-3-(4-methylsulfanylphenyl)-1-oxidanylidene-3,4-dihydroisoquinoline-4-carboxamide

Systemtic Name: N-(3-chloranyl-4-methoxy-phenyl)-6,7-dimethoxy-2-methyl-3-(4-methylsulfanylphenyl)-1-oxidanylidene-3,4-dihydroisoquinoline-4-carboxamide Openeye Name: N-(3-chloro-4-methoxy-phenyl)-6,7-dimethoxy-2-methyl-3-(4-methylsulfanylphenyl)-1-oxo-3,4-dihydroisoquinoline-4-carboxamide CAS Name: N-(3-chloro-4-methoxyphenyl)-6,7-dimethoxy-2-methyl-3-[4-(methylthio)phenyl]-1-oxo-3,4-dihydroisoquinoline-4-carboxamide IUPAC Name: N-(3-chloro-4-methoxyphenyl)-6,7-dimethoxy-2-methyl-3-(4-methylsulfanylphenyl)-1-oxo-3,4-dihydroisoquinoline-4-carboxamide Traditional Name: N-(3-chloro-4-methoxy-phenyl)-1-keto-6,7-dimethoxy-2-methyl-3-[4-(methylthio)phenyl]-3,4-dihydroisoquinoline-4-carboxamide Formula: C27H27ClN2O5S MolecularWeight: 527.03168

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(C(C2=CC(=C(C=C2C1=O)OC)OC)C(=O)NC3=CC(=C(C=C3)OC)Cl)C4=CC=C(C=C4)SC

Isomeric SMILES

CN1C(C(C2=CC(=C(C=C2C1=O)OC)OC)C(=O)NC3=CC(=C(C=C3)OC)Cl)C4=CC=C(C=C4)SC

InChI

InChI=1S/C27H27ClN2O5S/c1-30-25(15-6-9-17(36-5)10-7-15)24(26(31)29-16-8-11-21(33-2)20(28)12-16)18-13-22(34-3)23(35-4)14-19(18)27(30)32/h6-14,24-25H,1-5H3,(H,29,31)