N-(3-cyanothiophen-2-yl)-2-(7-methoxy-4-phenyl-quinolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(3-cyanothiophen-2-yl)-2-(7-methoxy-4-phenyl-quinolin-2-yl)sulfanyl-ethanamide Openeye Name: N-(3-cyano-2-thienyl)-2-[(7-methoxy-4-phenyl-2-quinolyl)sulfanyl]acetamide CAS Name: N-(3-cyano-2-thiophenyl)-2-[(7-methoxy-4-phenyl-2-quinolinyl)thio]acetamide IUPAC Name: N-(3-cyanothiophen-2-yl)-2-(7-methoxy-4-phenylquinolin-2-yl)sulfanylacetamide Traditional Name: N-(3-cyano-2-thienyl)-2-[(7-methoxy-4-phenyl-2-quinolyl)thio]acetamide Formula: C23H17N3O2S2 MolecularWeight: 431.52998

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=CC(=N2)SCC(=O)NC3=C(C=CS3)C#N)C4=CC=CC=C4

Isomeric SMILES

COC1=CC2=C(C=C1)C(=CC(=N2)SCC(=O)NC3=C(C=CS3)C#N)C4=CC=CC=C4

InChI

InChI=1S/C23H17N3O2S2/c1-28-17-7-8-18-19(15-5-3-2-4-6-15)12-22(25-20(18)11-17)30-14-21(27)26-23-16(13-24)9-10-29-23/h2-12H,14H2,1H3,(H,26,27)