methyl 5-(1H-benzimidazol-2-ylsulfanylmethyl)furan-2-carboxylate

Systemtic Name: methyl 5-(1H-benzimidazol-2-ylsulfanylmethyl)furan-2-carboxylate Openeye Name: methyl 5-(1H-benzimidazol-2-ylsulfanylmethyl)furan-2-carboxylate CAS Name: 5-[(1H-benzimidazol-2-ylthio)methyl]-2-furancarboxylic acid methyl ester IUPAC Name: methyl 5-(1H-benzimidazol-2-ylsulfanylmethyl)furan-2-carboxylate Traditional Name: 5-[(1H-benzimidazol-2-ylthio)methyl]furan-2-carboxylic acid methyl ester Formula: C14H12N2O3S MolecularWeight: 288.32168

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(O1)CSC2=NC3=CC=CC=C3N2

Isomeric SMILES

COC(=O)C1=CC=C(O1)CSC2=NC3=CC=CC=C3N2

InChI

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