2-[(1-methylimidazol-2-yl)sulfanylmethyl]furan-3-carboxylic acid

Systemtic Name: 2-[(1-methylimidazol-2-yl)sulfanylmethyl]furan-3-carboxylic acid Openeye Name: 2-[(1-methylimidazol-2-yl)sulfanylmethyl]furan-3-carboxylic acid CAS Name: 2-[[(1-methyl-2-imidazolyl)thio]methyl]-3-furancarboxylic acid IUPAC Name: 2-[(1-methylimidazol-2-yl)sulfanylmethyl]furan-3-carboxylic acid Traditional Name: 2-[[(1-methylimidazol-2-yl)thio]methyl]-3-furoic acid Formula: C10H10N2O3S MolecularWeight: 238.263

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1SCC2=C(C=CO2)C(=O)O

Isomeric SMILES

CN1C=CN=C1SCC2=C(C=CO2)C(=O)O

InChI

InChI=1S/C10H10N2O3S/c1-12-4-3-11-10(12)16-6-8-7(9(13)14)2-5-15-8/h2-5H,6H2,1H3,(H,13,14)