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

Systemtic Name: N-(6-ethyl-1,3-benzothiazol-2-yl)-4-oxidanylidene-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Openeye Name: N-(6-ethyl-1,3-benzothiazol-2-yl)-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide CAS Name: N-(6-ethyl-1,3-benzothiazol-2-yl)-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide IUPAC Name: N-(6-ethyl-1,3-benzothiazol-2-yl)-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Traditional Name: N-(6-ethyl-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:

CCC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC4=C(C=C3)SCCC(=O)N4

Isomeric SMILES

CCC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC4=C(C=C3)SCCC(=O)N4

InChI

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