2-(3-cyano-6,7-dimethoxy-quinolin-2-yl)sulfanyl-N,N-diphenyl-ethanamide

Systemtic Name: 2-(3-cyano-6,7-dimethoxy-quinolin-2-yl)sulfanyl-N,N-diphenyl-ethanamide Openeye Name: 2-[(3-cyano-6,7-dimethoxy-2-quinolyl)sulfanyl]-N,N-diphenyl-acetamide CAS Name: 2-[(3-cyano-6,7-dimethoxy-2-quinolinyl)thio]-N,N-diphenylacetamide IUPAC Name: 2-(3-cyano-6,7-dimethoxyquinolin-2-yl)sulfanyl-N,N-diphenylacetamide Traditional Name: 2-[(3-cyano-6,7-dimethoxy-2-quinolyl)thio]-N,N-diphenyl-acetamide Formula: C26H21N3O3S MolecularWeight: 455.52824

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C=C(C(=N2)SCC(=O)N(C3=CC=CC=C3)C4=CC=CC=C4)C#N)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C=C(C(=N2)SCC(=O)N(C3=CC=CC=C3)C4=CC=CC=C4)C#N)OC

InChI

InChI=1S/C26H21N3O3S/c1-31-23-14-18-13-19(16-27)26(28-22(18)15-24(23)32-2)33-17-25(30)29(20-9-5-3-6-10-20)21-11-7-4-8-12-21/h3-15H,17H2,1-2H3