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

Systemtic Name: 2-[[1-(naphthalen-2-ylmethyl)benzimidazol-2-yl]sulfanylmethyl]benzoic acid Openeye Name: 2-[[1-(2-naphthylmethyl)benzimidazol-2-yl]sulfanylmethyl]benzoic acid CAS Name: 2-[[[1-(2-naphthalenylmethyl)-2-benzimidazolyl]thio]methyl]benzoic acid IUPAC Name: 2-[[1-(naphthalen-2-ylmethyl)benzimidazol-2-yl]sulfanylmethyl]benzoic acid Traditional Name: 2-[[[1-(2-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=C(C=CC2=C1)CN3C4=CC=CC=C4N=C3SCC5=CC=CC=C5C(=O)O

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)CN3C4=CC=CC=C4N=C3SCC5=CC=CC=C5C(=O)O

InChI

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