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

Systemtic Name: N-(2-cyano-3-methyl-butan-2-yl)-2-(7-methoxy-4-phenyl-quinolin-2-yl)sulfanyl-ethanamide Openeye Name: N-(1-cyano-1,2-dimethyl-propyl)-2-[(7-methoxy-4-phenyl-2-quinolyl)sulfanyl]acetamide CAS Name: N-(2-cyano-3-methylbutan-2-yl)-2-[(7-methoxy-4-phenyl-2-quinolinyl)thio]acetamide IUPAC Name: N-(2-cyano-3-methylbutan-2-yl)-2-(7-methoxy-4-phenylquinolin-2-yl)sulfanylacetamide Traditional Name: N-(1-cyano-1,2-dimethyl-propyl)-2-[(7-methoxy-4-phenyl-2-quinolyl)thio]acetamide Formula: C24H25N3O2S MolecularWeight: 419.5392

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C)(C#N)NC(=O)CSC1=NC2=C(C=CC(=C2)OC)C(=C1)C3=CC=CC=C3

Isomeric SMILES

CC(C)C(C)(C#N)NC(=O)CSC1=NC2=C(C=CC(=C2)OC)C(=C1)C3=CC=CC=C3

InChI

InChI=1S/C24H25N3O2S/c1-16(2)24(3,15-25)27-22(28)14-30-23-13-20(17-8-6-5-7-9-17)19-11-10-18(29-4)12-21(19)26-23/h5-13,16H,14H2,1-4H3,(H,27,28)