6,7-dimethoxy-2-methyl-4-(4-methylpiperazin-1-yl)carbonyl-3-(4-methylsulfanylphenyl)-3,4-dihydroisoquinolin-1-one

Systemtic Name: 6,7-dimethoxy-2-methyl-4-(4-methylpiperazin-1-yl)carbonyl-3-(4-methylsulfanylphenyl)-3,4-dihydroisoquinolin-1-one Openeye Name: 6,7-dimethoxy-2-methyl-4-(4-methylpiperazine-1-carbonyl)-3-(4-methylsulfanylphenyl)-3,4-dihydroisoquinolin-1-one CAS Name: 6,7-dimethoxy-2-methyl-4-[(4-methyl-1-piperazinyl)-oxomethyl]-3-[4-(methylthio)phenyl]-3,4-dihydroisoquinolin-1-one IUPAC Name: 6,7-dimethoxy-2-methyl-4-(4-methylpiperazine-1-carbonyl)-3-(4-methylsulfanylphenyl)-3,4-dihydroisoquinolin-1-one Traditional Name: 6,7-dimethoxy-2-methyl-4-(4-methylpiperazine-1-carbonyl)-3-[4-(methylthio)phenyl]-3,4-dihydroisocarbostyril Formula: C25H31N3O4S MolecularWeight: 469.59634

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=O)C2C(N(C(=O)C3=CC(=C(C=C23)OC)OC)C)C4=CC=C(C=C4)SC

Isomeric SMILES

CN1CCN(CC1)C(=O)C2C(N(C(=O)C3=CC(=C(C=C23)OC)OC)C)C4=CC=C(C=C4)SC

InChI

InChI=1S/C25H31N3O4S/c1-26-10-12-28(13-11-26)25(30)22-18-14-20(31-3)21(32-4)15-19(18)24(29)27(2)23(22)16-6-8-17(33-5)9-7-16/h6-9,14-15,22-23H,10-13H2,1-5H3