4-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-1-(3-methylsulfanylphenyl)pyrrolidin-2-one

Systemtic Name: 4-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-1-(3-methylsulfanylphenyl)pyrrolidin-2-one Openeye Name: 4-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-1-(3-methylsulfanylphenyl)pyrrolidin-2-one CAS Name: 4-[3,4-dihydro-1H-isoquinolin-2-yl(oxo)methyl]-1-[3-(methylthio)phenyl]-2-pyrrolidinone IUPAC Name: 4-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-1-(3-methylsulfanylphenyl)pyrrolidin-2-one Traditional Name: 4-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-1-[3-(methylthio)phenyl]-2-pyrrolidone Formula: C21H22N2O2S MolecularWeight: 366.47658

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC(=C1)N2CC(CC2=O)C(=O)N3CCC4=CC=CC=C4C3

Isomeric SMILES

CSC1=CC=CC(=C1)N2CC(CC2=O)C(=O)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C21H22N2O2S/c1-26-19-8-4-7-18(12-19)23-14-17(11-20(23)24)21(25)22-10-9-15-5-2-3-6-16(15)13-22/h2-8,12,17H,9-11,13-14H2,1H3