N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-4-[(2-oxidanyl-2,2-diphenyl-ethanoyl)amino]benzamide

Systemtic Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-4-[(2-oxidanyl-2,2-diphenyl-ethanoyl)amino]benzamide Openeye Name: N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-4-[(2-hydroxy-2,2-diphenyl-acetyl)amino]benzamide CAS Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-4-[(2-hydroxy-1-oxo-2,2-diphenylethyl)amino]benzamide IUPAC Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-4-[(2-hydroxy-2,2-diphenylacetyl)amino]benzamide Traditional Name: 4-(benziloylamino)-N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)benzamide Formula: C30H25N3O3S MolecularWeight: 507.6028

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=C(S2)NC(=O)C3=CC=C(C=C3)NC(=O)C(C4=CC=CC=C4)(C5=CC=CC=C5)O)C#N

Isomeric SMILES

C1CCC2=C(C1)C(=C(S2)NC(=O)C3=CC=C(C=C3)NC(=O)C(C4=CC=CC=C4)(C5=CC=CC=C5)O)C#N

InChI

InChI=1S/C30H25N3O3S/c31-19-25-24-13-7-8-14-26(24)37-28(25)33-27(34)20-15-17-23(18-16-20)32-29(35)30(36,21-9-3-1-4-10-21)22-11-5-2-6-12-22/h1-6,9-12,15-18,36H,7-8,13-14H2,(H,32,35)(H,33,34)