4-methylsulfanyl-2-[(4-sulfamoylphenyl)carbonylamino]butanoic acid

Systemtic Name: 4-methylsulfanyl-2-[(4-sulfamoylphenyl)carbonylamino]butanoic acid Openeye Name: 4-methylsulfanyl-2-[(4-sulfamoylbenzoyl)amino]butanoic acid CAS Name: 4-(methylthio)-2-[[oxo-(4-sulfamoylphenyl)methyl]amino]butanoic acid IUPAC Name: 4-methylsulfanyl-2-[(4-sulfamoylbenzoyl)amino]butanoic acid Traditional Name: 4-(methylthio)-2-[(4-sulfamoylbenzoyl)amino]butyric acid Formula: C12H16N2O5S2 MolecularWeight: 332.39584

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)O)NC(=O)C1=CC=C(C=C1)S(=O)(=O)N

Isomeric SMILES

CSCCC(C(=O)O)NC(=O)C1=CC=C(C=C1)S(=O)(=O)N

InChI

InChI=1S/C12H16N2O5S2/c1-20-7-6-10(12(16)17)14-11(15)8-2-4-9(5-3-8)21(13,18)19/h2-5,10H,6-7H2,1H3,(H,14,15)(H,16,17)(H2,13,18,19)