3-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]-4-oxidanyl-5-oxidanylidene-2H-furan-2-carboxylic acid

Systemtic Name: 3-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]-4-oxidanyl-5-oxidanylidene-2H-furan-2-carboxylic acid Openeye Name: 4-hydroxy-3-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]-5-oxo-2H-furan-2-carboxylic acid CAS Name: 4-hydroxy-3-[(6-methyl-1H-benzimidazol-2-yl)thio]-5-oxo-2H-furan-2-carboxylic acid IUPAC Name: 4-hydroxy-3-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]-5-oxo-2H-furan-2-carboxylic acid Traditional Name: 4-hydroxy-5-keto-3-[(6-methyl-1H-benzimidazol-2-yl)thio]-2H-furan-2-carboxylic acid Formula: C13H10N2O5S MolecularWeight: 306.2939

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(N2)SC3=C(C(=O)OC3C(=O)O)O

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(N2)SC3=C(C(=O)OC3C(=O)O)O

InChI

InChI=1S/C13H10N2O5S/c1-5-2-3-6-7(4-5)15-13(14-6)21-10-8(16)12(19)20-9(10)11(17)18/h2-4,9,16H,1H3,(H,14,15)(H,17,18)