N-[2-[(6,7-dimethoxyisoquinolin-1-yl)methyl]-4,5-dimethoxy-phenyl]-2-methoxy-4-methylsulfanyl-benzamide

Systemtic Name: N-[2-[(6,7-dimethoxyisoquinolin-1-yl)methyl]-4,5-dimethoxy-phenyl]-2-methoxy-4-methylsulfanyl-benzamide Openeye Name: N-[2-[(6,7-dimethoxy-1-isoquinolyl)methyl]-4,5-dimethoxy-phenyl]-2-methoxy-4-methylsulfanyl-benzamide CAS Name: N-[2-[(6,7-dimethoxy-1-isoquinolinyl)methyl]-4,5-dimethoxyphenyl]-2-methoxy-4-(methylthio)benzamide IUPAC Name: N-[2-[(6,7-dimethoxyisoquinolin-1-yl)methyl]-4,5-dimethoxyphenyl]-2-methoxy-4-methylsulfanylbenzamide Traditional Name: N-[2-[(6,7-dimethoxy-1-isoquinolyl)methyl]-4,5-dimethoxy-phenyl]-2-methoxy-4-(methylthio)benzamide Formula: C29H30N2O6S MolecularWeight: 534.6233

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C=CN=C2CC3=CC(=C(C=C3NC(=O)C4=C(C=C(C=C4)SC)OC)OC)OC)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C=CN=C2CC3=CC(=C(C=C3NC(=O)C4=C(C=C(C=C4)SC)OC)OC)OC)OC

InChI

InChI=1S/C29H30N2O6S/c1-33-24-14-19(38-6)7-8-20(24)29(32)31-22-16-28(37-5)26(35-3)13-18(22)11-23-21-15-27(36-4)25(34-2)12-17(21)9-10-30-23/h7-10,12-16H,11H2,1-6H3,(H,31,32)