1-[(4-oxidanylidene-3,5-dihydro-2H-1,5-benzothiazepin-7-yl)carbonyl]piperidine-4-carboxamide

Systemtic Name: 1-[(4-oxidanylidene-3,5-dihydro-2H-1,5-benzothiazepin-7-yl)carbonyl]piperidine-4-carboxamide Openeye Name: 1-(4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-carbonyl)piperidine-4-carboxamide CAS Name: 1-[oxo-(4-oxo-3,5-dihydro-2H-1,5-benzothiazepin-7-yl)methyl]-4-piperidinecarboxamide IUPAC Name: 1-(4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-carbonyl)piperidine-4-carboxamide Traditional Name: 1-(4-keto-3,5-dihydro-2H-1,5-benzothiazepine-7-carbonyl)isonipecotamide Formula: C16H19N3O3S MolecularWeight: 333.40536

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)N)C(=O)C2=CC3=C(C=C2)SCCC(=O)N3

Isomeric SMILES

C1CN(CCC1C(=O)N)C(=O)C2=CC3=C(C=C2)SCCC(=O)N3

InChI

InChI=1S/C16H19N3O3S/c17-15(21)10-3-6-19(7-4-10)16(22)11-1-2-13-12(9-11)18-14(20)5-8-23-13/h1-2,9-10H,3-8H2,(H2,17,21)(H,18,20)