N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-4-oxidanylidene-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide

Systemtic Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-4-oxidanylidene-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Openeye Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide CAS Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide IUPAC Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Traditional Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-4-keto-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Formula: C19H17N3O2S2 MolecularWeight: 383.48718

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)SC(=N2)NC(=O)C3=CC4=C(C=C3)SCCC(=O)N4)C

Isomeric SMILES

CC1=CC(=C2C(=C1)SC(=N2)NC(=O)C3=CC4=C(C=C3)SCCC(=O)N4)C

InChI

InChI=1S/C19H17N3O2S2/c1-10-7-11(2)17-15(8-10)26-19(21-17)22-18(24)12-3-4-14-13(9-12)20-16(23)5-6-25-14/h3-4,7-9H,5-6H2,1-2H3,(H,20,23)(H,21,22,24)