3-[1-(naphthalen-1-ylmethyl)benzimidazol-2-yl]sulfanylpropanoic acid

Systemtic Name: 3-[1-(naphthalen-1-ylmethyl)benzimidazol-2-yl]sulfanylpropanoic acid Openeye Name: 3-[1-(1-naphthylmethyl)benzimidazol-2-yl]sulfanylpropanoic acid CAS Name: 3-[[1-(1-naphthalenylmethyl)-2-benzimidazolyl]thio]propanoic acid IUPAC Name: 3-[1-(naphthalen-1-ylmethyl)benzimidazol-2-yl]sulfanylpropanoic acid Traditional Name: 3-[[1-(1-naphthylmethyl)benzimidazol-2-yl]thio]propionic acid Formula: C21H18N2O2S MolecularWeight: 362.44482

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2CN3C4=CC=CC=C4N=C3SCCC(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2CN3C4=CC=CC=C4N=C3SCCC(=O)O

InChI

InChI=1S/C21H18N2O2S/c24-20(25)12-13-26-21-22-18-10-3-4-11-19(18)23(21)14-16-8-5-7-15-6-1-2-9-17(15)16/h1-11H,12-14H2,(H,24,25)