N-(1,3-benzodioxol-5-yl)-6,7-dimethoxy-2-methyl-3-(4-methylsulfanylphenyl)-1-oxidanylidene-3,4-dihydroisoquinoline-4-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-6,7-dimethoxy-2-methyl-3-(4-methylsulfanylphenyl)-1-oxidanylidene-3,4-dihydroisoquinoline-4-carboxamide Openeye Name: N-(1,3-benzodioxol-5-yl)-6,7-dimethoxy-2-methyl-3-(4-methylsulfanylphenyl)-1-oxo-3,4-dihydroisoquinoline-4-carboxamide CAS Name: N-(1,3-benzodioxol-5-yl)-6,7-dimethoxy-2-methyl-3-[4-(methylthio)phenyl]-1-oxo-3,4-dihydroisoquinoline-4-carboxamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-6,7-dimethoxy-2-methyl-3-(4-methylsulfanylphenyl)-1-oxo-3,4-dihydroisoquinoline-4-carboxamide Traditional Name: N-(1,3-benzodioxol-5-yl)-1-keto-6,7-dimethoxy-2-methyl-3-[4-(methylthio)phenyl]-3,4-dihydroisoquinoline-4-carboxamide Formula: C27H26N2O6S MolecularWeight: 506.57014

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(C(C2=CC(=C(C=C2C1=O)OC)OC)C(=O)NC3=CC4=C(C=C3)OCO4)C5=CC=C(C=C5)SC

Isomeric SMILES

CN1C(C(C2=CC(=C(C=C2C1=O)OC)OC)C(=O)NC3=CC4=C(C=C3)OCO4)C5=CC=C(C=C5)SC

InChI

InChI=1S/C27H26N2O6S/c1-29-25(15-5-8-17(36-4)9-6-15)24(18-12-21(32-2)22(33-3)13-19(18)27(29)31)26(30)28-16-7-10-20-23(11-16)35-14-34-20/h5-13,24-25H,14H2,1-4H3,(H,28,30)