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

Systemtic Name: 4-oxidanylidene-N-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Openeye Name: 4-oxo-N-(2-oxo-2-pyrrolidin-1-yl-ethyl)-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide CAS Name: 4-oxo-N-[2-oxo-2-(1-pyrrolidinyl)ethyl]-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide IUPAC Name: 4-oxo-N-(2-oxo-2-pyrrolidin-1-ylethyl)-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Traditional Name: 4-keto-N-(2-keto-2-pyrrolidino-ethyl)-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Formula: C16H19N3O3S MolecularWeight: 333.40536

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)CNC(=O)C2=CC3=C(C=C2)SCCC(=O)N3

Isomeric SMILES

C1CCN(C1)C(=O)CNC(=O)C2=CC3=C(C=C2)SCCC(=O)N3

InChI

InChI=1S/C16H19N3O3S/c20-14-5-8-23-13-4-3-11(9-12(13)18-14)16(22)17-10-15(21)19-6-1-2-7-19/h3-4,9H,1-2,5-8,10H2,(H,17,22)(H,18,20)