3-(pyrimidin-2-ylsulfanylmethyl)furan-2-carboxylic acid

Systemtic Name: 3-(pyrimidin-2-ylsulfanylmethyl)furan-2-carboxylic acid Openeye Name: 3-(pyrimidin-2-ylsulfanylmethyl)furan-2-carboxylic acid CAS Name: 3-[(2-pyrimidinylthio)methyl]-2-furancarboxylic acid IUPAC Name: 3-(pyrimidin-2-ylsulfanylmethyl)furan-2-carboxylic acid Traditional Name: 3-[(2-pyrimidylthio)methyl]-2-furoic acid Formula: C10H8N2O3S MolecularWeight: 236.24712

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(N=C1)SCC2=C(OC=C2)C(=O)O

Isomeric SMILES

C1=CN=C(N=C1)SCC2=C(OC=C2)C(=O)O

InChI

InChI=1S/C10H8N2O3S/c13-9(14)8-7(2-5-15-8)6-16-10-11-3-1-4-12-10/h1-5H,6H2,(H,13,14)