2-(3-cyano-6,8-dimethyl-quinolin-2-yl)sulfanyl-N-[(4-methylphenyl)methyl]ethanamide

Systemtic Name: 2-(3-cyano-6,8-dimethyl-quinolin-2-yl)sulfanyl-N-[(4-methylphenyl)methyl]ethanamide Openeye Name: 2-[(3-cyano-6,8-dimethyl-2-quinolyl)sulfanyl]-N-(p-tolylmethyl)acetamide CAS Name: 2-[(3-cyano-6,8-dimethyl-2-quinolinyl)thio]-N-[(4-methylphenyl)methyl]acetamide IUPAC Name: 2-(3-cyano-6,8-dimethylquinolin-2-yl)sulfanyl-N-[(4-methylphenyl)methyl]acetamide Traditional Name: 2-[(3-cyano-6,8-dimethyl-2-quinolyl)thio]-N-(4-methylbenzyl)acetamide Formula: C22H21N3OS MolecularWeight: 375.48664

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)CSC2=NC3=C(C=C(C=C3C=C2C#N)C)C

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)CSC2=NC3=C(C=C(C=C3C=C2C#N)C)C

InChI

InChI=1S/C22H21N3OS/c1-14-4-6-17(7-5-14)12-24-20(26)13-27-22-19(11-23)10-18-9-15(2)8-16(3)21(18)25-22/h4-10H,12-13H2,1-3H3,(H,24,26)