N-[2-(4-methylphenyl)sulfanylethyl]-2-(1-oxidanylideneisoquinolin-2-yl)ethanamide

Systemtic Name: N-[2-(4-methylphenyl)sulfanylethyl]-2-(1-oxidanylideneisoquinolin-2-yl)ethanamide Openeye Name: 2-(1-oxo-2-isoquinolyl)-N-[2-(p-tolylsulfanyl)ethyl]acetamide CAS Name: N-[2-[(4-methylphenyl)thio]ethyl]-2-(1-oxo-2-isoquinolinyl)acetamide IUPAC Name: N-[2-(4-methylphenyl)sulfanylethyl]-2-(1-oxoisoquinolin-2-yl)acetamide Traditional Name: 2-(1-keto-2-isoquinolyl)-N-[2-(p-tolylthio)ethyl]acetamide Formula: C20H20N2O2S MolecularWeight: 352.45

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCCNC(=O)CN2C=CC3=CC=CC=C3C2=O

Isomeric SMILES

CC1=CC=C(C=C1)SCCNC(=O)CN2C=CC3=CC=CC=C3C2=O

InChI

InChI=1S/C20H20N2O2S/c1-15-6-8-17(9-7-15)25-13-11-21-19(23)14-22-12-10-16-4-2-3-5-18(16)20(22)24/h2-10,12H,11,13-14H2,1H3,(H,21,23)