methyl 4-[[1-(4-methylphenyl)benzimidazol-2-yl]sulfanylmethyl]benzoate

Systemtic Name: methyl 4-[[1-(4-methylphenyl)benzimidazol-2-yl]sulfanylmethyl]benzoate Openeye Name: methyl 4-[[1-(p-tolyl)benzimidazol-2-yl]sulfanylmethyl]benzoate CAS Name: 4-[[[1-(4-methylphenyl)-2-benzimidazolyl]thio]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[1-(4-methylphenyl)benzimidazol-2-yl]sulfanylmethyl]benzoate Traditional Name: 4-[[[1-(p-tolyl)benzimidazol-2-yl]thio]methyl]benzoic acid methyl ester Formula: C23H20N2O2S MolecularWeight: 388.4821

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C3=CC=CC=C3N=C2SCC4=CC=C(C=C4)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)N2C3=CC=CC=C3N=C2SCC4=CC=C(C=C4)C(=O)OC

InChI

InChI=1S/C23H20N2O2S/c1-16-7-13-19(14-8-16)25-21-6-4-3-5-20(21)24-23(25)28-15-17-9-11-18(12-10-17)22(26)27-2/h3-14H,15H2,1-2H3