methyl 5-[[1-(4-ethoxyphenyl)benzimidazol-2-yl]sulfanylmethyl]furan-2-carboxylate

Systemtic Name: methyl 5-[[1-(4-ethoxyphenyl)benzimidazol-2-yl]sulfanylmethyl]furan-2-carboxylate Openeye Name: methyl 5-[[1-(4-ethoxyphenyl)benzimidazol-2-yl]sulfanylmethyl]furan-2-carboxylate CAS Name: 5-[[[1-(4-ethoxyphenyl)-2-benzimidazolyl]thio]methyl]-2-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[[1-(4-ethoxyphenyl)benzimidazol-2-yl]sulfanylmethyl]furan-2-carboxylate Traditional Name: 5-[[(1-p-phenetylbenzimidazol-2-yl)thio]methyl]furan-2-carboxylic acid methyl ester Formula: C22H20N2O4S MolecularWeight: 408.4702

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C3=CC=CC=C3N=C2SCC4=CC=C(O4)C(=O)OC

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C3=CC=CC=C3N=C2SCC4=CC=C(O4)C(=O)OC

InChI

InChI=1S/C22H20N2O4S/c1-3-27-16-10-8-15(9-11-16)24-19-7-5-4-6-18(19)23-22(24)29-14-17-12-13-20(28-17)21(25)26-2/h4-13H,3,14H2,1-2H3