N-(2-cyanoethyl)-N-methyl-2-(4,6,8-trimethylquinolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(2-cyanoethyl)-N-methyl-2-(4,6,8-trimethylquinolin-2-yl)sulfanyl-ethanamide Openeye Name: N-(2-cyanoethyl)-N-methyl-2-[(4,6,8-trimethyl-2-quinolyl)sulfanyl]acetamide CAS Name: N-(2-cyanoethyl)-N-methyl-2-[(4,6,8-trimethyl-2-quinolinyl)thio]acetamide IUPAC Name: N-(2-cyanoethyl)-N-methyl-2-(4,6,8-trimethylquinolin-2-yl)sulfanylacetamide Traditional Name: N-(2-cyanoethyl)-N-methyl-2-[(4,6,8-trimethyl-2-quinolyl)thio]acetamide Formula: C18H21N3OS MolecularWeight: 327.44384

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C(=CC(=N2)SCC(=O)N(C)CCC#N)C)C

Isomeric SMILES

CC1=CC(=C2C(=C1)C(=CC(=N2)SCC(=O)N(C)CCC#N)C)C

InChI

InChI=1S/C18H21N3OS/c1-12-8-14(3)18-15(9-12)13(2)10-16(20-18)23-11-17(22)21(4)7-5-6-19/h8-10H,5,7,11H2,1-4H3