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

Systemtic Name: N-(2-methyl-1,3-benzothiazol-6-yl)-4-oxidanylidene-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Openeye Name: N-(2-methyl-1,3-benzothiazol-6-yl)-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide CAS Name: N-(2-methyl-1,3-benzothiazol-6-yl)-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide IUPAC Name: N-(2-methyl-1,3-benzothiazol-6-yl)-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Traditional Name: 4-keto-N-(2-methyl-1,3-benzothiazol-6-yl)-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Formula: C18H15N3O2S2 MolecularWeight: 369.4606

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(S1)C=C(C=C2)NC(=O)C3=CC4=C(C=C3)SCCC(=O)N4

Isomeric SMILES

CC1=NC2=C(S1)C=C(C=C2)NC(=O)C3=CC4=C(C=C3)SCCC(=O)N4

InChI

InChI=1S/C18H15N3O2S2/c1-10-19-13-4-3-12(9-16(13)25-10)20-18(23)11-2-5-15-14(8-11)21-17(22)6-7-24-15/h2-5,8-9H,6-7H2,1H3,(H,20,23)(H,21,22)