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

Systemtic Name: N-ethyl-2-methyl-4-oxidanylidene-N-phenyl-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide Openeye Name: N-ethyl-2-methyl-4-oxo-N-phenyl-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide CAS Name: N-ethyl-2-methyl-4-oxo-N-phenyl-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide IUPAC Name: N-ethyl-2-methyl-4-oxo-N-phenyl-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide Traditional Name: N-ethyl-4-keto-2-methyl-N-phenyl-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide Formula: C18H20N2O3S2 MolecularWeight: 376.493

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC=C1)S(=O)(=O)C2=CC3=C(C=C2)SC(CC(=O)N3)C

Isomeric SMILES

CCN(C1=CC=CC=C1)S(=O)(=O)C2=CC3=C(C=C2)SC(CC(=O)N3)C

InChI

InChI=1S/C18H20N2O3S2/c1-3-20(14-7-5-4-6-8-14)25(22,23)15-9-10-17-16(12-15)19-18(21)11-13(2)24-17/h4-10,12-13H,3,11H2,1-2H3,(H,19,21)