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

Systemtic Name: N-(4-bromophenyl)-2-[(3-cyano-7,7-dimethyl-5-oxidanylidene-4-propan-2-yl-1,4,6,8-tetrahydroquinolin-2-yl)sulfanyl]-2-phenyl-ethanamide Openeye Name: N-(4-bromophenyl)-2-[(3-cyano-4-isopropyl-7,7-dimethyl-5-oxo-1,4,6,8-tetrahydroquinolin-2-yl)sulfanyl]-2-phenyl-acetamide CAS Name: N-(4-bromophenyl)-2-[(3-cyano-7,7-dimethyl-5-oxo-4-propan-2-yl-1,4,6,8-tetrahydroquinolin-2-yl)thio]-2-phenylacetamide IUPAC Name: N-(4-bromophenyl)-2-[(3-cyano-7,7-dimethyl-5-oxo-4-propan-2-yl-1,4,6,8-tetrahydroquinolin-2-yl)sulfanyl]-2-phenylacetamide Traditional Name: N-(4-bromophenyl)-2-[(3-cyano-4-isopropyl-5-keto-7,7-dimethyl-1,4,6,8-tetrahydroquinolin-2-yl)thio]-2-phenyl-acetamide Formula: C29H30BrN3O2S MolecularWeight: 564.5364

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1C(=C(NC2=C1C(=O)CC(C2)(C)C)SC(C3=CC=CC=C3)C(=O)NC4=CC=C(C=C4)Br)C#N

Isomeric SMILES

CC(C)C1C(=C(NC2=C1C(=O)CC(C2)(C)C)SC(C3=CC=CC=C3)C(=O)NC4=CC=C(C=C4)Br)C#N

InChI

InChI=1S/C29H30BrN3O2S/c1-17(2)24-21(16-31)28(33-22-14-29(3,4)15-23(34)25(22)24)36-26(18-8-6-5-7-9-18)27(35)32-20-12-10-19(30)11-13-20/h5-13,17,24,26,33H,14-15H2,1-4H3,(H,32,35)