2-[2-oxidanylidene-2-[(3-sulfamoylphenyl)amino]ethyl]sulfanylpyrimidin-4-olate

Systemtic Name: 2-[2-oxidanylidene-2-[(3-sulfamoylphenyl)amino]ethyl]sulfanylpyrimidin-4-olate Openeye Name: 2-[2-oxo-2-(3-sulfamoylanilino)ethyl]sulfanylpyrimidin-4-olate CAS Name: 2-[[2-oxo-2-(3-sulfamoylanilino)ethyl]thio]-4-pyrimidinolate IUPAC Name: 2-[2-oxo-2-(3-sulfamoylanilino)ethyl]sulfanylpyrimidin-4-olate Traditional Name: 2-[[2-keto-2-(3-sulfamoylanilino)ethyl]thio]pyrimidin-4-olate Formula: C12H11N4O4S2- MolecularWeight: 339.37014

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)S(=O)(=O)N)NC(=O)CSC2=NC=CC(=N2)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)S(=O)(=O)N)NC(=O)CSC2=NC=CC(=N2)[O-]

InChI

InChI=1S/C12H12N4O4S2/c13-22(19,20)9-3-1-2-8(6-9)15-11(18)7-21-12-14-5-4-10(17)16-12/h1-6H,7H2,(H,15,18)(H2,13,19,20)(H,14,16,17)/p-1