N-cyclohexyl-6,7-dimethoxy-2-methyl-3-(4-methylsulfanylphenyl)-1-oxidanylidene-isoquinoline-4-carboxamide

Systemtic Name: N-cyclohexyl-6,7-dimethoxy-2-methyl-3-(4-methylsulfanylphenyl)-1-oxidanylidene-isoquinoline-4-carboxamide Openeye Name: N-cyclohexyl-6,7-dimethoxy-2-methyl-3-(4-methylsulfanylphenyl)-1-oxo-isoquinoline-4-carboxamide CAS Name: N-cyclohexyl-6,7-dimethoxy-2-methyl-3-[4-(methylthio)phenyl]-1-oxo-4-isoquinolinecarboxamide IUPAC Name: N-cyclohexyl-6,7-dimethoxy-2-methyl-3-(4-methylsulfanylphenyl)-1-oxoisoquinoline-4-carboxamide Traditional Name: N-cyclohexyl-1-keto-6,7-dimethoxy-2-methyl-3-[4-(methylthio)phenyl]isoquinoline-4-carboxamide Formula: C26H30N2O4S MolecularWeight: 466.5924

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C2=CC(=C(C=C2C1=O)OC)OC)C(=O)NC3CCCCC3)C4=CC=C(C=C4)SC

Isomeric SMILES

CN1C(=C(C2=CC(=C(C=C2C1=O)OC)OC)C(=O)NC3CCCCC3)C4=CC=C(C=C4)SC

InChI

InChI=1S/C26H30N2O4S/c1-28-24(16-10-12-18(33-4)13-11-16)23(25(29)27-17-8-6-5-7-9-17)19-14-21(31-2)22(32-3)15-20(19)26(28)30/h10-15,17H,5-9H2,1-4H3,(H,27,29)