2-[[3-cyano-4-(4-methoxyphenyl)-7,7-dimethyl-5-oxidanylidene-1,4,6,8-tetrahydroquinolin-2-yl]sulfanyl]-N-phenyl-ethanamide

Systemtic Name: 2-[[3-cyano-4-(4-methoxyphenyl)-7,7-dimethyl-5-oxidanylidene-1,4,6,8-tetrahydroquinolin-2-yl]sulfanyl]-N-phenyl-ethanamide Openeye Name: 2-[[3-cyano-4-(4-methoxyphenyl)-7,7-dimethyl-5-oxo-1,4,6,8-tetrahydroquinolin-2-yl]sulfanyl]-N-phenyl-acetamide CAS Name: 2-[[3-cyano-4-(4-methoxyphenyl)-7,7-dimethyl-5-oxo-1,4,6,8-tetrahydroquinolin-2-yl]thio]-N-phenylacetamide IUPAC Name: 2-[[3-cyano-4-(4-methoxyphenyl)-7,7-dimethyl-5-oxo-1,4,6,8-tetrahydroquinolin-2-yl]sulfanyl]-N-phenylacetamide Traditional Name: 2-[[3-cyano-5-keto-4-(4-methoxyphenyl)-7,7-dimethyl-1,4,6,8-tetrahydroquinolin-2-yl]thio]-N-phenyl-acetamide Formula: C27H27N3O3S MolecularWeight: 473.58658

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(C(=C(N2)SCC(=O)NC3=CC=CC=C3)C#N)C4=CC=C(C=C4)OC)C(=O)C1)C

Isomeric SMILES

CC1(CC2=C(C(C(=C(N2)SCC(=O)NC3=CC=CC=C3)C#N)C4=CC=C(C=C4)OC)C(=O)C1)C

InChI

InChI=1S/C27H27N3O3S/c1-27(2)13-21-25(22(31)14-27)24(17-9-11-19(33-3)12-10-17)20(15-28)26(30-21)34-16-23(32)29-18-7-5-4-6-8-18/h4-12,24,30H,13-14,16H2,1-3H3,(H,29,32)