N-[[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]methyl]-2,1,3-benzothiadiazole-4-sulfonamide

Systemtic Name: N-[[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]methyl]-2,1,3-benzothiadiazole-4-sulfonamide Openeye Name: N-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]-2,1,3-benzothiadiazole-4-sulfonamide CAS Name: N-[[4-(2-oxo-1-pyrrolidinyl)phenyl]methyl]-2,1,3-benzothiadiazole-4-sulfonamide IUPAC Name: N-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]-2,1,3-benzothiadiazole-4-sulfonamide Traditional Name: N-[4-(2-ketopyrrolidino)benzyl]piazthiole-4-sulfonamide Formula: C17H16N4O3S2 MolecularWeight: 388.46394

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)C2=CC=C(C=C2)CNS(=O)(=O)C3=CC=CC4=NSN=C43

Isomeric SMILES

C1CC(=O)N(C1)C2=CC=C(C=C2)CNS(=O)(=O)C3=CC=CC4=NSN=C43

InChI

InChI=1S/C17H16N4O3S2/c22-16-5-2-10-21(16)13-8-6-12(7-9-13)11-18-26(23,24)15-4-1-3-14-17(15)20-25-19-14/h1,3-4,6-9,18H,2,5,10-11H2