N-(3-methylphenyl)-2-quinolin-2-ylsulfanyl-butanamide

Systemtic Name: N-(3-methylphenyl)-2-quinolin-2-ylsulfanyl-butanamide Openeye Name: N-(m-tolyl)-2-(2-quinolylsulfanyl)butanamide CAS Name: N-(3-methylphenyl)-2-(2-quinolinylthio)butanamide IUPAC Name: N-(3-methylphenyl)-2-quinolin-2-ylsulfanylbutanamide Traditional Name: N-(m-tolyl)-2-(2-quinolylthio)butyramide Formula: C20H20N2OS MolecularWeight: 336.4506

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=CC(=C1)C)SC2=NC3=CC=CC=C3C=C2

Isomeric SMILES

CCC(C(=O)NC1=CC=CC(=C1)C)SC2=NC3=CC=CC=C3C=C2

InChI

InChI=1S/C20H20N2OS/c1-3-18(20(23)21-16-9-6-7-14(2)13-16)24-19-12-11-15-8-4-5-10-17(15)22-19/h4-13,18H,3H2,1-2H3,(H,21,23)