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

Systemtic Name: 2-(3-cyano-6-methoxy-quinolin-2-yl)sulfanyl-N-[(4-methylphenyl)methyl]ethanamide Openeye Name: 2-[(3-cyano-6-methoxy-2-quinolyl)sulfanyl]-N-(p-tolylmethyl)acetamide CAS Name: 2-[(3-cyano-6-methoxy-2-quinolinyl)thio]-N-[(4-methylphenyl)methyl]acetamide IUPAC Name: 2-(3-cyano-6-methoxyquinolin-2-yl)sulfanyl-N-[(4-methylphenyl)methyl]acetamide Traditional Name: 2-[(3-cyano-6-methoxy-2-quinolyl)thio]-N-(4-methylbenzyl)acetamide Formula: C21H19N3O2S MolecularWeight: 377.45946

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)CSC2=NC3=C(C=C(C=C3)OC)C=C2C#N

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)CSC2=NC3=C(C=C(C=C3)OC)C=C2C#N

InChI

InChI=1S/C21H19N3O2S/c1-14-3-5-15(6-4-14)12-23-20(25)13-27-21-17(11-22)9-16-10-18(26-2)7-8-19(16)24-21/h3-10H,12-13H2,1-2H3,(H,23,25)