5-[2-(1H-benzimidazol-2-yl)ethylsulfamoyl]-6-oxidanylidene-1H-pyrimidin-2-olate

Systemtic Name: 5-[2-(1H-benzimidazol-2-yl)ethylsulfamoyl]-6-oxidanylidene-1H-pyrimidin-2-olate Openeye Name: 5-[2-(1H-benzimidazol-2-yl)ethylsulfamoyl]-6-oxo-1H-pyrimidin-2-olate CAS Name: 5-[2-(1H-benzimidazol-2-yl)ethylsulfamoyl]-6-oxo-1H-pyrimidin-2-olate IUPAC Name: 5-[2-(1H-benzimidazol-2-yl)ethylsulfamoyl]-6-oxo-1H-pyrimidin-2-olate Traditional Name: 5-[2-(1H-benzimidazol-2-yl)ethylsulfamoyl]-6-keto-1H-pyrimidin-2-olate Formula: C13H12N5O4S- MolecularWeight: 334.33048

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=N2)CCNS(=O)(=O)C3=CN=C(NC3=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)NC(=N2)CCNS(=O)(=O)C3=CN=C(NC3=O)[O-]

InChI

InChI=1S/C13H13N5O4S/c19-12-10(7-14-13(20)18-12)23(21,22)15-6-5-11-16-8-3-1-2-4-9(8)17-11/h1-4,7,15H,5-6H2,(H,16,17)(H2,14,18,19,20)/p-1