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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2N1CCNC(=O)C3=CC4=C(C=C3)SCCC(=O)N4

Isomeric SMILES

CC1=NC2=CC=CC=C2N1CCNC(=O)C3=CC4=C(C=C3)SCCC(=O)N4

InChI

InChI=1S/C20H20N4O2S/c1-13-22-15-4-2-3-5-17(15)24(13)10-9-21-20(26)14-6-7-18-16(12-14)23-19(25)8-11-27-18/h2-7,12H,8-11H2,1H3,(H,21,26)(H,23,25)