N-(2-acetamidoethyl)-4-oxidanylidene-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide

Systemtic Name: N-(2-acetamidoethyl)-4-oxidanylidene-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Openeye Name: N-(2-acetamidoethyl)-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide CAS Name: N-(2-acetamidoethyl)-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide IUPAC Name: N-(2-acetamidoethyl)-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Traditional Name: N-(2-acetamidoethyl)-4-keto-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Formula: C14H17N3O3S MolecularWeight: 307.36808

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCNC(=O)C1=CC2=C(C=C1)SCCC(=O)N2

Isomeric SMILES

CC(=O)NCCNC(=O)C1=CC2=C(C=C1)SCCC(=O)N2

InChI

InChI=1S/C14H17N3O3S/c1-9(18)15-5-6-16-14(20)10-2-3-12-11(8-10)17-13(19)4-7-21-12/h2-3,8H,4-7H2,1H3,(H,15,18)(H,16,20)(H,17,19)