2-(3-cyano-6,7-dimethyl-quinolin-2-yl)sulfanyl-N-(4-methoxyphenyl)ethanamide

Systemtic Name: 2-(3-cyano-6,7-dimethyl-quinolin-2-yl)sulfanyl-N-(4-methoxyphenyl)ethanamide Openeye Name: 2-[(3-cyano-6,7-dimethyl-2-quinolyl)sulfanyl]-N-(4-methoxyphenyl)acetamide CAS Name: 2-[(3-cyano-6,7-dimethyl-2-quinolinyl)thio]-N-(4-methoxyphenyl)acetamide IUPAC Name: 2-(3-cyano-6,7-dimethylquinolin-2-yl)sulfanyl-N-(4-methoxyphenyl)acetamide Traditional Name: 2-[(3-cyano-6,7-dimethyl-2-quinolyl)thio]-N-(4-methoxyphenyl)acetamide Formula: C21H19N3O2S MolecularWeight: 377.45946

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C=C(C(=N2)SCC(=O)NC3=CC=C(C=C3)OC)C#N)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C=C(C(=N2)SCC(=O)NC3=CC=C(C=C3)OC)C#N)C

InChI

InChI=1S/C21H19N3O2S/c1-13-8-15-10-16(11-22)21(24-19(15)9-14(13)2)27-12-20(25)23-17-4-6-18(26-3)7-5-17/h4-10H,12H2,1-3H3,(H,23,25)