N-(4-methoxyphenyl)-2-[1-(pyridin-3-ylmethyl)benzimidazol-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(4-methoxyphenyl)-2-[1-(pyridin-3-ylmethyl)benzimidazol-2-yl]sulfanyl-ethanamide Openeye Name: N-(4-methoxyphenyl)-2-[1-(3-pyridylmethyl)benzimidazol-2-yl]sulfanyl-acetamide CAS Name: N-(4-methoxyphenyl)-2-[[1-(3-pyridinylmethyl)-2-benzimidazolyl]thio]acetamide IUPAC Name: N-(4-methoxyphenyl)-2-[1-(pyridin-3-ylmethyl)benzimidazol-2-yl]sulfanylacetamide Traditional Name: N-(4-methoxyphenyl)-2-[[1-(3-pyridylmethyl)benzimidazol-2-yl]thio]acetamide Formula: C22H20N4O2S MolecularWeight: 404.4848

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3N2CC4=CN=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3N2CC4=CN=CC=C4

InChI

InChI=1S/C22H20N4O2S/c1-28-18-10-8-17(9-11-18)24-21(27)15-29-22-25-19-6-2-3-7-20(19)26(22)14-16-5-4-12-23-13-16/h2-13H,14-15H2,1H3,(H,24,27)