2-[[1-(naphthalen-1-ylmethyl)benzimidazol-2-yl]sulfanylmethyl]benzoic acid

Systemtic Name: 2-[[1-(naphthalen-1-ylmethyl)benzimidazol-2-yl]sulfanylmethyl]benzoic acid Openeye Name: 2-[[1-(1-naphthylmethyl)benzimidazol-2-yl]sulfanylmethyl]benzoic acid CAS Name: 2-[[[1-(1-naphthalenylmethyl)-2-benzimidazolyl]thio]methyl]benzoic acid IUPAC Name: 2-[[1-(naphthalen-1-ylmethyl)benzimidazol-2-yl]sulfanylmethyl]benzoic acid Traditional Name: 2-[[[1-(1-naphthylmethyl)benzimidazol-2-yl]thio]methyl]benzoic acid Formula: C26H20N2O2S MolecularWeight: 424.5142

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2CN3C4=CC=CC=C4N=C3SCC5=CC=CC=C5C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2CN3C4=CC=CC=C4N=C3SCC5=CC=CC=C5C(=O)O

InChI

InChI=1S/C26H20N2O2S/c29-25(30)22-13-4-2-9-20(22)17-31-26-27-23-14-5-6-15-24(23)28(26)16-19-11-7-10-18-8-1-3-12-21(18)19/h1-15H,16-17H2,(H,29,30)