2-[[3-cyano-6-(2-methylbutan-2-yl)-5,6,7,8-tetrahydroquinolin-2-yl]sulfanyl]-N-naphthalen-1-yl-butanamide

Systemtic Name: 2-[[3-cyano-6-(2-methylbutan-2-yl)-5,6,7,8-tetrahydroquinolin-2-yl]sulfanyl]-N-naphthalen-1-yl-butanamide Openeye Name: 2-[[3-cyano-6-(1,1-dimethylpropyl)-5,6,7,8-tetrahydroquinolin-2-yl]sulfanyl]-N-(1-naphthyl)butanamide CAS Name: 2-[[3-cyano-6-(2-methylbutan-2-yl)-5,6,7,8-tetrahydroquinolin-2-yl]thio]-N-(1-naphthalenyl)butanamide IUPAC Name: 2-[[3-cyano-6-(2-methylbutan-2-yl)-5,6,7,8-tetrahydroquinolin-2-yl]sulfanyl]-N-naphthalen-1-ylbutanamide Traditional Name: 2-[(6-tert-amyl-3-cyano-5,6,7,8-tetrahydroquinolin-2-yl)thio]-N-(1-naphthyl)butyramide Formula: C29H33N3OS MolecularWeight: 471.65682

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=CC2=CC=CC=C21)SC3=NC4=C(CC(CC4)C(C)(C)CC)C=C3C#N

Isomeric SMILES

CCC(C(=O)NC1=CC=CC2=CC=CC=C21)SC3=NC4=C(CC(CC4)C(C)(C)CC)C=C3C#N

InChI

InChI=1S/C29H33N3OS/c1-5-26(27(33)31-25-13-9-11-19-10-7-8-12-23(19)25)34-28-21(18-30)16-20-17-22(29(3,4)6-2)14-15-24(20)32-28/h7-13,16,22,26H,5-6,14-15,17H2,1-4H3,(H,31,33)