4-[[2-(2-azanyl-2-oxidanylidene-ethyl)sulfanylphenyl]sulfamoyl]butanoic acid

Systemtic Name: 4-[[2-(2-azanyl-2-oxidanylidene-ethyl)sulfanylphenyl]sulfamoyl]butanoic acid Openeye Name: 4-[[2-(2-amino-2-oxo-ethyl)sulfanylphenyl]sulfamoyl]butanoic acid CAS Name: 4-[[2-[(2-amino-2-oxoethyl)thio]phenyl]sulfamoyl]butanoic acid IUPAC Name: 4-[[2-(2-amino-2-oxoethyl)sulfanylphenyl]sulfamoyl]butanoic acid Traditional Name: 4-[[2-[(2-amino-2-keto-ethyl)thio]phenyl]sulfamoyl]butyric acid Formula: C12H16N2O5S2 MolecularWeight: 332.39584

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NS(=O)(=O)CCCC(=O)O)SCC(=O)N

Isomeric SMILES

C1=CC=C(C(=C1)NS(=O)(=O)CCCC(=O)O)SCC(=O)N

InChI

InChI=1S/C12H16N2O5S2/c13-11(15)8-20-10-5-2-1-4-9(10)14-21(18,19)7-3-6-12(16)17/h1-2,4-5,14H,3,6-8H2,(H2,13,15)(H,16,17)