2-[1-(pyridin-2-ylmethyl)benzimidazol-2-yl]sulfanylethanoate

Systemtic Name: 2-[1-(pyridin-2-ylmethyl)benzimidazol-2-yl]sulfanylethanoate Openeye Name: 2-[1-(2-pyridylmethyl)benzimidazol-2-yl]sulfanylacetate CAS Name: 2-[[1-(2-pyridinylmethyl)-2-benzimidazolyl]thio]acetate IUPAC Name: 2-[1-(pyridin-2-ylmethyl)benzimidazol-2-yl]sulfanylacetate Traditional Name: 2-[[1-(2-pyridylmethyl)benzimidazol-2-yl]thio]acetate Formula: C15H12N3O2S- MolecularWeight: 298.33968

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(N2CC3=CC=CC=N3)SCC(=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)N=C(N2CC3=CC=CC=N3)SCC(=O)[O-]

InChI

InChI=1S/C15H13N3O2S/c19-14(20)10-21-15-17-12-6-1-2-7-13(12)18(15)9-11-5-3-4-8-16-11/h1-8H,9-10H2,(H,19,20)/p-1