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

Systemtic Name: N-(3-chloranyl-4-cyano-phenyl)-2-(7-methoxy-4-phenyl-quinolin-2-yl)sulfanyl-ethanamide Openeye Name: N-(3-chloro-4-cyano-phenyl)-2-[(7-methoxy-4-phenyl-2-quinolyl)sulfanyl]acetamide CAS Name: N-(3-chloro-4-cyanophenyl)-2-[(7-methoxy-4-phenyl-2-quinolinyl)thio]acetamide IUPAC Name: N-(3-chloro-4-cyanophenyl)-2-(7-methoxy-4-phenylquinolin-2-yl)sulfanylacetamide Traditional Name: N-(3-chloro-4-cyano-phenyl)-2-[(7-methoxy-4-phenyl-2-quinolyl)thio]acetamide Formula: C25H18ClN3O2S MolecularWeight: 459.94732

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=CC(=N2)SCC(=O)NC3=CC(=C(C=C3)C#N)Cl)C4=CC=CC=C4

Isomeric SMILES

COC1=CC2=C(C=C1)C(=CC(=N2)SCC(=O)NC3=CC(=C(C=C3)C#N)Cl)C4=CC=CC=C4

InChI

InChI=1S/C25H18ClN3O2S/c1-31-19-9-10-20-21(16-5-3-2-4-6-16)13-25(29-23(20)12-19)32-15-24(30)28-18-8-7-17(14-27)22(26)11-18/h2-13H,15H2,1H3,(H,28,30)