5-[(4,5-dimethyl-1H-imidazol-2-yl)sulfanylmethyl]furan-2-carboxylate

Systemtic Name: 5-[(4,5-dimethyl-1H-imidazol-2-yl)sulfanylmethyl]furan-2-carboxylate Openeye Name: 5-[(4,5-dimethyl-1H-imidazol-2-yl)sulfanylmethyl]furan-2-carboxylate CAS Name: 5-[[(4,5-dimethyl-1H-imidazol-2-yl)thio]methyl]-2-furancarboxylate IUPAC Name: 5-[(4,5-dimethyl-1H-imidazol-2-yl)sulfanylmethyl]furan-2-carboxylate Traditional Name: 5-[[(4,5-dimethyl-1H-imidazol-2-yl)thio]methyl]-2-furoate Formula: C11H11N2O3S- MolecularWeight: 251.28164

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(N1)SCC2=CC=C(O2)C(=O)[O-])C

Isomeric SMILES

CC1=C(N=C(N1)SCC2=CC=C(O2)C(=O)[O-])C

InChI

InChI=1S/C11H12N2O3S/c1-6-7(2)13-11(12-6)17-5-8-3-4-9(16-8)10(14)15/h3-4H,5H2,1-2H3,(H,12,13)(H,14,15)/p-1