N-[1-(1H-benzimidazol-2-yl)-2-phenyl-ethyl]-4-oxidanylidene-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide

Systemtic Name: N-[1-(1H-benzimidazol-2-yl)-2-phenyl-ethyl]-4-oxidanylidene-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Openeye Name: N-[1-(1H-benzimidazol-2-yl)-2-phenyl-ethyl]-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide CAS Name: N-[1-(1H-benzimidazol-2-yl)-2-phenylethyl]-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide IUPAC Name: N-[1-(1H-benzimidazol-2-yl)-2-phenylethyl]-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Traditional Name: N-[1-(1H-benzimidazol-2-yl)-2-phenyl-ethyl]-4-keto-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Formula: C25H22N4O2S MolecularWeight: 442.53278

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC2=C(C=C(C=C2)C(=O)NC(CC3=CC=CC=C3)C4=NC5=CC=CC=C5N4)NC1=O

Isomeric SMILES

C1CSC2=C(C=C(C=C2)C(=O)NC(CC3=CC=CC=C3)C4=NC5=CC=CC=C5N4)NC1=O

InChI

InChI=1S/C25H22N4O2S/c30-23-12-13-32-22-11-10-17(15-20(22)26-23)25(31)29-21(14-16-6-2-1-3-7-16)24-27-18-8-4-5-9-19(18)28-24/h1-11,15,21H,12-14H2,(H,26,30)(H,27,28)(H,29,31)