(2R)-N-(2-cyanoethyl)-2-(4,8-dimethylquinolin-2-yl)sulfanyl-N-methyl-propanamide

Systemtic Name: (2R)-N-(2-cyanoethyl)-2-(4,8-dimethylquinolin-2-yl)sulfanyl-N-methyl-propanamide Openeye Name: (2R)-N-(2-cyanoethyl)-2-[(4,8-dimethyl-2-quinolyl)sulfanyl]-N-methyl-propanamide CAS Name: (2R)-N-(2-cyanoethyl)-2-[(4,8-dimethyl-2-quinolinyl)thio]-N-methylpropanamide IUPAC Name: (2R)-N-(2-cyanoethyl)-2-(4,8-dimethylquinolin-2-yl)sulfanyl-N-methylpropanamide Traditional Name: (2R)-N-(2-cyanoethyl)-2-[(4,8-dimethyl-2-quinolyl)thio]-N-methyl-propionamide Formula: C18H21N3OS MolecularWeight: 327.44384

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N=C(C=C2C)SC(C)C(=O)N(C)CCC#N

Isomeric SMILES

CC1=CC=CC2=C1N=C(C=C2C)S[C@H](C)C(=O)N(C)CCC#N

InChI

InChI=1S/C18H21N3OS/c1-12-7-5-8-15-13(2)11-16(20-17(12)15)23-14(3)18(22)21(4)10-6-9-19/h5,7-8,11,14H,6,10H2,1-4H3/t14-/m1/s1