ethyl 2-[(2-methoxyphenyl)methylsulfanyl]-1-(pyridin-2-ylmethyl)benzimidazole-5-carboxylate

Systemtic Name: ethyl 2-[(2-methoxyphenyl)methylsulfanyl]-1-(pyridin-2-ylmethyl)benzimidazole-5-carboxylate Openeye Name: ethyl 2-[(2-methoxyphenyl)methylsulfanyl]-1-(2-pyridylmethyl)benzimidazole-5-carboxylate CAS Name: 2-[(2-methoxyphenyl)methylthio]-1-(2-pyridinylmethyl)-5-benzimidazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(2-methoxyphenyl)methylsulfanyl]-1-(pyridin-2-ylmethyl)benzimidazole-5-carboxylate Traditional Name: 2-(o-anisylthio)-1-(2-pyridylmethyl)benzimidazole-5-carboxylic acid ethyl ester Formula: C24H23N3O3S MolecularWeight: 433.52272

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(C=C1)N(C(=N2)SCC3=CC=CC=C3OC)CC4=CC=CC=N4

Isomeric SMILES

CCOC(=O)C1=CC2=C(C=C1)N(C(=N2)SCC3=CC=CC=C3OC)CC4=CC=CC=N4

InChI

InChI=1S/C24H23N3O3S/c1-3-30-23(28)17-11-12-21-20(14-17)26-24(27(21)15-19-9-6-7-13-25-19)31-16-18-8-4-5-10-22(18)29-2/h4-14H,3,15-16H2,1-2H3