2-(3-cyano-6,8-dimethyl-quinolin-2-yl)sulfanyl-N-(3-methoxyphenyl)ethanamide

Systemtic Name: 2-(3-cyano-6,8-dimethyl-quinolin-2-yl)sulfanyl-N-(3-methoxyphenyl)ethanamide Openeye Name: 2-[(3-cyano-6,8-dimethyl-2-quinolyl)sulfanyl]-N-(3-methoxyphenyl)acetamide CAS Name: 2-[(3-cyano-6,8-dimethyl-2-quinolinyl)thio]-N-(3-methoxyphenyl)acetamide IUPAC Name: 2-(3-cyano-6,8-dimethylquinolin-2-yl)sulfanyl-N-(3-methoxyphenyl)acetamide Traditional Name: 2-[(3-cyano-6,8-dimethyl-2-quinolyl)thio]-N-(3-methoxyphenyl)acetamide Formula: C21H19N3O2S MolecularWeight: 377.45946

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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