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

Systemtic Name: N-[(1-ethylbenzimidazol-2-yl)methyl]-4-oxidanylidene-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Openeye Name: N-[(1-ethylbenzimidazol-2-yl)methyl]-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide CAS Name: N-[(1-ethyl-2-benzimidazolyl)methyl]-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide IUPAC Name: N-[(1-ethylbenzimidazol-2-yl)methyl]-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Traditional Name: N-[(1-ethylbenzimidazol-2-yl)methyl]-4-keto-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Formula: C20H20N4O2S MolecularWeight: 380.4634

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2N=C1CNC(=O)C3=CC4=C(C=C3)SCCC(=O)N4

Isomeric SMILES

CCN1C2=CC=CC=C2N=C1CNC(=O)C3=CC4=C(C=C3)SCCC(=O)N4

InChI

InChI=1S/C20H20N4O2S/c1-2-24-16-6-4-3-5-14(16)22-18(24)12-21-20(26)13-7-8-17-15(11-13)23-19(25)9-10-27-17/h3-8,11H,2,9-10,12H2,1H3,(H,21,26)(H,23,25)