6,7-dimethoxy-2-methyl-3-(4-methylsulfanylphenyl)-4-pyrrolidin-1-ylcarbonyl-3,4-dihydroisoquinolin-1-one

Systemtic Name: 6,7-dimethoxy-2-methyl-3-(4-methylsulfanylphenyl)-4-pyrrolidin-1-ylcarbonyl-3,4-dihydroisoquinolin-1-one Openeye Name: 6,7-dimethoxy-2-methyl-3-(4-methylsulfanylphenyl)-4-(pyrrolidine-1-carbonyl)-3,4-dihydroisoquinolin-1-one CAS Name: 6,7-dimethoxy-2-methyl-3-[4-(methylthio)phenyl]-4-[oxo(1-pyrrolidinyl)methyl]-3,4-dihydroisoquinolin-1-one IUPAC Name: 6,7-dimethoxy-2-methyl-3-(4-methylsulfanylphenyl)-4-(pyrrolidine-1-carbonyl)-3,4-dihydroisoquinolin-1-one Traditional Name: 6,7-dimethoxy-2-methyl-3-[4-(methylthio)phenyl]-4-(pyrrolidine-1-carbonyl)-3,4-dihydroisocarbostyril Formula: C24H28N2O4S MolecularWeight: 440.55512

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(C(C2=CC(=C(C=C2C1=O)OC)OC)C(=O)N3CCCC3)C4=CC=C(C=C4)SC

Isomeric SMILES

CN1C(C(C2=CC(=C(C=C2C1=O)OC)OC)C(=O)N3CCCC3)C4=CC=C(C=C4)SC

InChI

InChI=1S/C24H28N2O4S/c1-25-22(15-7-9-16(31-4)10-8-15)21(24(28)26-11-5-6-12-26)17-13-19(29-2)20(30-3)14-18(17)23(25)27/h7-10,13-14,21-22H,5-6,11-12H2,1-4H3