2-[(4-sulfamoylphenyl)carbamothioylamino]ethanoic acid

Systemtic Name: 2-[(4-sulfamoylphenyl)carbamothioylamino]ethanoic acid Openeye Name: 2-[(4-sulfamoylphenyl)carbamothioylamino]acetic acid CAS Name: 2-[[(4-sulfamoylanilino)-sulfanylidenemethyl]amino]acetic acid IUPAC Name: 2-[(4-sulfamoylphenyl)carbamothioylamino]acetic acid Traditional Name: 2-[(4-sulfamoylphenyl)thiocarbamoylamino]acetic acid Formula: C9H11N3O4S2 MolecularWeight: 289.33134

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=S)NCC(=O)O)S(=O)(=O)N

Isomeric SMILES

C1=CC(=CC=C1NC(=S)NCC(=O)O)S(=O)(=O)N

InChI

InChI=1S/C9H11N3O4S2/c10-18(15,16)7-3-1-6(2-4-7)12-9(17)11-5-8(13)14/h1-4H,5H2,(H,13,14)(H2,10,15,16)(H2,11,12,17)