2-(3-acetamidophenyl)sulfanyl-N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-phenyl-ethanamide

Systemtic Name: 2-(3-acetamidophenyl)sulfanyl-N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-phenyl-ethanamide Openeye Name: 2-(3-acetamidophenyl)sulfanyl-N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-2-phenyl-acetamide CAS Name: 2-[(3-acetamidophenyl)thio]-N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-phenylacetamide IUPAC Name: 2-(3-acetamidophenyl)sulfanyl-N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-phenylacetamide Traditional Name: 2-[(3-acetamidophenyl)thio]-N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-2-phenyl-acetamide Formula: C29H31N3O2S2 MolecularWeight: 517.70534

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=CC=C1)SC(C2=CC=CC=C2)C(=O)NC3=C(C4=C(S3)CC(CC4)C(C)(C)C)C#N

Isomeric SMILES

CC(=O)NC1=CC(=CC=C1)SC(C2=CC=CC=C2)C(=O)NC3=C(C4=C(S3)CC(CC4)C(C)(C)C)C#N

InChI

InChI=1S/C29H31N3O2S2/c1-18(33)31-21-11-8-12-22(16-21)35-26(19-9-6-5-7-10-19)27(34)32-28-24(17-30)23-14-13-20(29(2,3)4)15-25(23)36-28/h5-12,16,20,26H,13-15H2,1-4H3,(H,31,33)(H,32,34)