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

Systemtic Name: 2-[[4-(4-chlorophenyl)-3-cyano-7,7-dimethyl-5-oxidanylidene-1,4,6,8-tetrahydroquinolin-2-yl]sulfanyl]-N-(2,4-dimethoxyphenyl)ethanamide Openeye Name: 2-[[4-(4-chlorophenyl)-3-cyano-7,7-dimethyl-5-oxo-1,4,6,8-tetrahydroquinolin-2-yl]sulfanyl]-N-(2,4-dimethoxyphenyl)acetamide CAS Name: 2-[[4-(4-chlorophenyl)-3-cyano-7,7-dimethyl-5-oxo-1,4,6,8-tetrahydroquinolin-2-yl]thio]-N-(2,4-dimethoxyphenyl)acetamide IUPAC Name: 2-[[4-(4-chlorophenyl)-3-cyano-7,7-dimethyl-5-oxo-1,4,6,8-tetrahydroquinolin-2-yl]sulfanyl]-N-(2,4-dimethoxyphenyl)acetamide Traditional Name: 2-[[4-(4-chlorophenyl)-3-cyano-5-keto-7,7-dimethyl-1,4,6,8-tetrahydroquinolin-2-yl]thio]-N-(2,4-dimethoxyphenyl)acetamide Formula: C28H28ClN3O4S MolecularWeight: 538.05762

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H28ClN3O4S/c1-28(2)12-21-26(22(33)13-28)25(16-5-7-17(29)8-6-16)19(14-30)27(32-21)37-15-24(34)31-20-10-9-18(35-3)11-23(20)36-4/h5-11,25,32H,12-13,15H2,1-4H3,(H,31,34)