N-(4-methylphenyl)-2-[methyl(2-quinolin-2-ylsulfanylethanoyl)amino]ethanamide

Systemtic Name: N-(4-methylphenyl)-2-[methyl(2-quinolin-2-ylsulfanylethanoyl)amino]ethanamide Openeye Name: 2-[methyl-[2-(2-quinolylsulfanyl)acetyl]amino]-N-(p-tolyl)acetamide CAS Name: 2-[methyl-[1-oxo-2-(2-quinolinylthio)ethyl]amino]-N-(4-methylphenyl)acetamide IUPAC Name: N-(4-methylphenyl)-2-[methyl-(2-quinolin-2-ylsulfanylacetyl)amino]acetamide Traditional Name: 2-[methyl-[2-(2-quinolylthio)acetyl]amino]-N-(p-tolyl)acetamide Formula: C21H21N3O2S MolecularWeight: 379.47534

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)CN(C)C(=O)CSC2=NC3=CC=CC=C3C=C2

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)CN(C)C(=O)CSC2=NC3=CC=CC=C3C=C2

InChI

InChI=1S/C21H21N3O2S/c1-15-7-10-17(11-8-15)22-19(25)13-24(2)21(26)14-27-20-12-9-16-5-3-4-6-18(16)23-20/h3-12H,13-14H2,1-2H3,(H,22,25)