5-[(6-methyl-1H-benzimidazol-2-yl)sulfanylmethyl]furan-2-carboxylate

Systemtic Name: 5-[(6-methyl-1H-benzimidazol-2-yl)sulfanylmethyl]furan-2-carboxylate Openeye Name: 5-[(6-methyl-1H-benzimidazol-2-yl)sulfanylmethyl]furan-2-carboxylate CAS Name: 5-[[(6-methyl-1H-benzimidazol-2-yl)thio]methyl]-2-furancarboxylate IUPAC Name: 5-[(6-methyl-1H-benzimidazol-2-yl)sulfanylmethyl]furan-2-carboxylate Traditional Name: 5-[[(6-methyl-1H-benzimidazol-2-yl)thio]methyl]-2-furoate Formula: C14H11N2O3S- MolecularWeight: 287.31374

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(N2)SCC3=CC=C(O3)C(=O)[O-]

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(N2)SCC3=CC=C(O3)C(=O)[O-]

InChI

InChI=1S/C14H12N2O3S/c1-8-2-4-10-11(6-8)16-14(15-10)20-7-9-3-5-12(19-9)13(17)18/h2-6H,7H2,1H3,(H,15,16)(H,17,18)/p-1