5-[methyl(2-pyridin-4-ylethyl)sulfamoyl]-6-oxidanylidene-1H-pyrimidin-2-olate

Systemtic Name: 5-[methyl(2-pyridin-4-ylethyl)sulfamoyl]-6-oxidanylidene-1H-pyrimidin-2-olate Openeye Name: 5-[methyl-[2-(4-pyridyl)ethyl]sulfamoyl]-6-oxo-1H-pyrimidin-2-olate CAS Name: 5-[methyl(2-pyridin-4-ylethyl)sulfamoyl]-6-oxo-1H-pyrimidin-2-olate IUPAC Name: 5-[methyl(2-pyridin-4-ylethyl)sulfamoyl]-6-oxo-1H-pyrimidin-2-olate Traditional Name: 6-keto-5-[methyl-[2-(4-pyridyl)ethyl]sulfamoyl]-1H-pyrimidin-2-olate Formula: C12H13N4O4S- MolecularWeight: 309.32102

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=CC=NC=C1)S(=O)(=O)C2=CN=C(NC2=O)[O-]

Isomeric SMILES

CN(CCC1=CC=NC=C1)S(=O)(=O)C2=CN=C(NC2=O)[O-]

InChI

InChI=1S/C12H14N4O4S/c1-16(7-4-9-2-5-13-6-3-9)21(19,20)10-8-14-12(18)15-11(10)17/h2-3,5-6,8H,4,7H2,1H3,(H2,14,15,17,18)/p-1