4-oxidanylidene-N-[3-(2-oxidanylidenepyrrolidin-1-yl)propyl]-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide

Systemtic Name: 4-oxidanylidene-N-[3-(2-oxidanylidenepyrrolidin-1-yl)propyl]-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide Openeye Name: 4-oxo-N-[3-(2-oxopyrrolidin-1-yl)propyl]-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide CAS Name: 4-oxo-N-[3-(2-oxo-1-pyrrolidinyl)propyl]-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide IUPAC Name: 4-oxo-N-[3-(2-oxopyrrolidin-1-yl)propyl]-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide Traditional Name: 4-keto-N-[3-(2-ketopyrrolidino)propyl]-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide Formula: C16H21N3O4S2 MolecularWeight: 383.48564

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)CCCNS(=O)(=O)C2=CC3=C(C=C2)SCCC(=O)N3

Isomeric SMILES

C1CC(=O)N(C1)CCCNS(=O)(=O)C2=CC3=C(C=C2)SCCC(=O)N3

InChI

InChI=1S/C16H21N3O4S2/c20-15-6-10-24-14-5-4-12(11-13(14)18-15)25(22,23)17-7-2-9-19-8-1-3-16(19)21/h4-5,11,17H,1-3,6-10H2,(H,18,20)