potassium 6-oxidanylidene-1-phenyl-2-(phenylmethylsulfanyl)pyrimidin-4-olate

Systemtic Name: potassium 6-oxidanylidene-1-phenyl-2-(phenylmethylsulfanyl)pyrimidin-4-olate Openeye Name: potassium 2-benzylsulfanyl-6-oxo-1-phenyl-pyrimidin-4-olate CAS Name: potassium 6-oxo-1-phenyl-2-(phenylmethylthio)-4-pyrimidinolate IUPAC Name: potassium 2-benzylsulfanyl-6-oxo-1-phenylpyrimidin-4-olate Traditional Name: potassium 2-(benzylthio)-6-keto-1-phenyl-pyrimidin-4-olate Formula: C17H13KN2O2S MolecularWeight: 348.46062

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=NC(=CC(=O)N2C3=CC=CC=C3)[O-].[K+]

Isomeric SMILES

C1=CC=C(C=C1)CSC2=NC(=CC(=O)N2C3=CC=CC=C3)[O-].[K+]

InChI

InChI=1S/C17H14N2O2S.K/c20-15-11-16(21)19(14-9-5-2-6-10-14)17(18-15)22-12-13-7-3-1-4-8-13;/h1-11,20H,12H2;/q;+1/p-1