2-[[3-cyano-4-(4-propan-2-ylphenyl)-5,6,7,8-tetrahydroquinolin-2-yl]sulfanyl]-N-phenyl-ethanamide

Systemtic Name: 2-[[3-cyano-4-(4-propan-2-ylphenyl)-5,6,7,8-tetrahydroquinolin-2-yl]sulfanyl]-N-phenyl-ethanamide Openeye Name: 2-[[3-cyano-4-(4-isopropylphenyl)-5,6,7,8-tetrahydroquinolin-2-yl]sulfanyl]-N-phenyl-acetamide CAS Name: 2-[[3-cyano-4-(4-propan-2-ylphenyl)-5,6,7,8-tetrahydroquinolin-2-yl]thio]-N-phenylacetamide IUPAC Name: 2-[[3-cyano-4-(4-propan-2-ylphenyl)-5,6,7,8-tetrahydroquinolin-2-yl]sulfanyl]-N-phenylacetamide Traditional Name: 2-[(3-cyano-4-p-cumenyl-5,6,7,8-tetrahydroquinolin-2-yl)thio]-N-phenyl-acetamide Formula: C27H27N3OS MolecularWeight: 441.58778

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C2=C(C(=NC3=C2CCCC3)SCC(=O)NC4=CC=CC=C4)C#N

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C2=C(C(=NC3=C2CCCC3)SCC(=O)NC4=CC=CC=C4)C#N

InChI

InChI=1S/C27H27N3OS/c1-18(2)19-12-14-20(15-13-19)26-22-10-6-7-11-24(22)30-27(23(26)16-28)32-17-25(31)29-21-8-4-3-5-9-21/h3-5,8-9,12-15,18H,6-7,10-11,17H2,1-2H3,(H,29,31)