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

Systemtic Name: 6,7-dimethoxy-2-methyl-3-(4-methylsulfanylphenyl)-4-piperidin-1-ylcarbonyl-3,4-dihydroisoquinolin-1-one Openeye Name: 6,7-dimethoxy-2-methyl-3-(4-methylsulfanylphenyl)-4-(piperidine-1-carbonyl)-3,4-dihydroisoquinolin-1-one CAS Name: 6,7-dimethoxy-2-methyl-3-[4-(methylthio)phenyl]-4-[oxo(1-piperidinyl)methyl]-3,4-dihydroisoquinolin-1-one IUPAC Name: 6,7-dimethoxy-2-methyl-3-(4-methylsulfanylphenyl)-4-(piperidine-1-carbonyl)-3,4-dihydroisoquinolin-1-one Traditional Name: 6,7-dimethoxy-2-methyl-3-[4-(methylthio)phenyl]-4-(piperidine-1-carbonyl)-3,4-dihydroisocarbostyril Formula: C25H30N2O4S MolecularWeight: 454.5817

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(C(C2=CC(=C(C=C2C1=O)OC)OC)C(=O)N3CCCCC3)C4=CC=C(C=C4)SC

Isomeric SMILES

CN1C(C(C2=CC(=C(C=C2C1=O)OC)OC)C(=O)N3CCCCC3)C4=CC=C(C=C4)SC

InChI

InChI=1S/C25H30N2O4S/c1-26-23(16-8-10-17(32-4)11-9-16)22(25(29)27-12-6-5-7-13-27)18-14-20(30-2)21(31-3)15-19(18)24(26)28/h8-11,14-15,22-23H,5-7,12-13H2,1-4H3