N-(2-cyanoethyl)-N-(4-methylphenyl)-2-quinolin-2-ylsulfanyl-ethanamide

Systemtic Name: N-(2-cyanoethyl)-N-(4-methylphenyl)-2-quinolin-2-ylsulfanyl-ethanamide Openeye Name: N-(2-cyanoethyl)-N-(p-tolyl)-2-(2-quinolylsulfanyl)acetamide CAS Name: N-(2-cyanoethyl)-N-(4-methylphenyl)-2-(2-quinolinylthio)acetamide IUPAC Name: N-(2-cyanoethyl)-N-(4-methylphenyl)-2-quinolin-2-ylsulfanylacetamide Traditional Name: N-(2-cyanoethyl)-N-(p-tolyl)-2-(2-quinolylthio)acetamide Formula: C21H19N3OS MolecularWeight: 361.46006

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N(CCC#N)C(=O)CSC2=NC3=CC=CC=C3C=C2

Isomeric SMILES

CC1=CC=C(C=C1)N(CCC#N)C(=O)CSC2=NC3=CC=CC=C3C=C2

InChI

InChI=1S/C21H19N3OS/c1-16-7-10-18(11-8-16)24(14-4-13-22)21(25)15-26-20-12-9-17-5-2-3-6-19(17)23-20/h2-3,5-12H,4,14-15H2,1H3