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

Systemtic Name: N-[1-(1H-benzimidazol-2-yl)ethyl]-4-oxidanylidene-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Openeye Name: N-[1-(1H-benzimidazol-2-yl)ethyl]-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide CAS Name: N-[1-(1H-benzimidazol-2-yl)ethyl]-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide IUPAC Name: N-[1-(1H-benzimidazol-2-yl)ethyl]-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Traditional Name: N-[1-(1H-benzimidazol-2-yl)ethyl]-4-keto-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Formula: C19H18N4O2S MolecularWeight: 366.43682

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC2=CC=CC=C2N1)NC(=O)C3=CC4=C(C=C3)SCCC(=O)N4

Isomeric SMILES

CC(C1=NC2=CC=CC=C2N1)NC(=O)C3=CC4=C(C=C3)SCCC(=O)N4

InChI

InChI=1S/C19H18N4O2S/c1-11(18-22-13-4-2-3-5-14(13)23-18)20-19(25)12-6-7-16-15(10-12)21-17(24)8-9-26-16/h2-7,10-11H,8-9H2,1H3,(H,20,25)(H,21,24)(H,22,23)