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

Systemtic Name: 6-oxidanylidene-5-[(phenylmethyl)-(2-pyridin-2-ylethyl)sulfamoyl]-1H-pyrimidin-2-olate Openeye Name: 5-[benzyl-[2-(2-pyridyl)ethyl]sulfamoyl]-6-oxo-1H-pyrimidin-2-olate CAS Name: 6-oxo-5-[(phenylmethyl)-[2-(2-pyridinyl)ethyl]sulfamoyl]-1H-pyrimidin-2-olate IUPAC Name: 5-[benzyl(2-pyridin-2-ylethyl)sulfamoyl]-6-oxo-1H-pyrimidin-2-olate Traditional Name: 5-[benzyl-[2-(2-pyridyl)ethyl]sulfamoyl]-6-keto-1H-pyrimidin-2-olate Formula: C18H17N4O4S- MolecularWeight: 385.41698

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(CCC2=CC=CC=N2)S(=O)(=O)C3=CN=C(NC3=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CN(CCC2=CC=CC=N2)S(=O)(=O)C3=CN=C(NC3=O)[O-]

InChI

InChI=1S/C18H18N4O4S/c23-17-16(12-20-18(24)21-17)27(25,26)22(13-14-6-2-1-3-7-14)11-9-15-8-4-5-10-19-15/h1-8,10,12H,9,11,13H2,(H2,20,21,23,24)/p-1