2-(2-carboxyethylsulfanyl)-6-thiophen-2-yl-pyrimidin-4-olate

Systemtic Name: 2-(2-carboxyethylsulfanyl)-6-thiophen-2-yl-pyrimidin-4-olate Openeye Name: 2-(2-carboxyethylsulfanyl)-6-(2-thienyl)pyrimidin-4-olate CAS Name: 2-(2-carboxyethylthio)-6-thiophen-2-yl-4-pyrimidinolate IUPAC Name: 2-(2-carboxyethylsulfanyl)-6-thiophen-2-ylpyrimidin-4-olate Traditional Name: 2-(2-carboxyethylthio)-6-(2-thienyl)pyrimidin-4-olate Formula: C11H9N2O3S2- MolecularWeight: 281.33076

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C2=CC(=NC(=N2)SCCC(=O)O)[O-]

Isomeric SMILES

C1=CSC(=C1)C2=CC(=NC(=N2)SCCC(=O)O)[O-]

InChI

InChI=1S/C11H10N2O3S2/c14-9-6-7(8-2-1-4-17-8)12-11(13-9)18-5-3-10(15)16/h1-2,4,6H,3,5H2,(H,15,16)(H,12,13,14)/p-1