N,N-diethyl-3-methyl-4-oxidanylidene-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide

Systemtic Name: N,N-diethyl-3-methyl-4-oxidanylidene-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide Openeye Name: N,N-diethyl-3-methyl-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide CAS Name: N,N-diethyl-3-methyl-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide IUPAC Name: N,N-diethyl-3-methyl-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide Traditional Name: N,N-diethyl-4-keto-3-methyl-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide Formula: C14H20N2O3S2 MolecularWeight: 328.4502

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC2=C(C=C1)SCC(C(=O)N2)C

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC2=C(C=C1)SCC(C(=O)N2)C

InChI

InChI=1S/C14H20N2O3S2/c1-4-16(5-2)21(18,19)11-6-7-13-12(8-11)15-14(17)10(3)9-20-13/h6-8,10H,4-5,9H2,1-3H3,(H,15,17)