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

Systemtic Name: 2-(3-acetamidophenyl)sulfanyl-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-phenyl-ethanamide Openeye Name: 2-(3-acetamidophenyl)sulfanyl-N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-2-phenyl-acetamide CAS Name: 2-[(3-acetamidophenyl)thio]-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-phenylacetamide IUPAC Name: 2-(3-acetamidophenyl)sulfanyl-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-phenylacetamide Traditional Name: 2-[(3-acetamidophenyl)thio]-N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-2-phenyl-acetamide Formula: C25H23N3O2S2 MolecularWeight: 461.59902

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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)CCCC4)C#N

Isomeric SMILES

CC(=O)NC1=CC(=CC=C1)SC(C2=CC=CC=C2)C(=O)NC3=C(C4=C(S3)CCCC4)C#N

InChI

InChI=1S/C25H23N3O2S2/c1-16(29)27-18-10-7-11-19(14-18)31-23(17-8-3-2-4-9-17)24(30)28-25-21(15-26)20-12-5-6-13-22(20)32-25/h2-4,7-11,14,23H,5-6,12-13H2,1H3,(H,27,29)(H,28,30)