methyl 4-[[5-chloranyl-1-(phenylmethyl)benzimidazol-2-yl]sulfanylmethyl]benzoate

Systemtic Name: methyl 4-[[5-chloranyl-1-(phenylmethyl)benzimidazol-2-yl]sulfanylmethyl]benzoate Openeye Name: methyl 4-[(1-benzyl-5-chloro-benzimidazol-2-yl)sulfanylmethyl]benzoate CAS Name: 4-[[[5-chloro-1-(phenylmethyl)-2-benzimidazolyl]thio]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(1-benzyl-5-chlorobenzimidazol-2-yl)sulfanylmethyl]benzoate Traditional Name: 4-[[(1-benzyl-5-chloro-benzimidazol-2-yl)thio]methyl]benzoic acid methyl ester Formula: C23H19ClN2O2S MolecularWeight: 422.92716

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CSC2=NC3=C(N2CC4=CC=CC=C4)C=CC(=C3)Cl

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CSC2=NC3=C(N2CC4=CC=CC=C4)C=CC(=C3)Cl

InChI

InChI=1S/C23H19ClN2O2S/c1-28-22(27)18-9-7-17(8-10-18)15-29-23-25-20-13-19(24)11-12-21(20)26(23)14-16-5-3-2-4-6-16/h2-13H,14-15H2,1H3