2-methyl-N-(3-morpholin-4-ylpropyl)-4-oxidanylidene-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide

Systemtic Name: 2-methyl-N-(3-morpholin-4-ylpropyl)-4-oxidanylidene-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide Openeye Name: 2-methyl-N-(3-morpholinopropyl)-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide CAS Name: 2-methyl-N-[3-(4-morpholinyl)propyl]-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide IUPAC Name: 2-methyl-N-(3-morpholin-4-ylpropyl)-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide Traditional Name: 4-keto-2-methyl-N-(3-morpholinopropyl)-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide Formula: C17H25N3O4S2 MolecularWeight: 399.5281

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=O)NC2=C(S1)C=CC(=C2)S(=O)(=O)NCCCN3CCOCC3

Isomeric SMILES

CC1CC(=O)NC2=C(S1)C=CC(=C2)S(=O)(=O)NCCCN3CCOCC3

InChI

InChI=1S/C17H25N3O4S2/c1-13-11-17(21)19-15-12-14(3-4-16(15)25-13)26(22,23)18-5-2-6-20-7-9-24-10-8-20/h3-4,12-13,18H,2,5-11H2,1H3,(H,19,21)