4-[1-[(8-methylnaphthalen-1-yl)methyl]benzimidazol-2-yl]sulfanylbutanoic acid

Systemtic Name: 4-[1-[(8-methylnaphthalen-1-yl)methyl]benzimidazol-2-yl]sulfanylbutanoic acid Openeye Name: 4-[1-[(8-methyl-1-naphthyl)methyl]benzimidazol-2-yl]sulfanylbutanoic acid CAS Name: 4-[[1-[(8-methyl-1-naphthalenyl)methyl]-2-benzimidazolyl]thio]butanoic acid IUPAC Name: 4-[1-[(8-methylnaphthalen-1-yl)methyl]benzimidazol-2-yl]sulfanylbutanoic acid Traditional Name: 4-[[1-[(8-methyl-1-naphthyl)methyl]benzimidazol-2-yl]thio]butyric acid Formula: C23H22N2O2S MolecularWeight: 390.49798

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1C(=CC=C2)CN3C4=CC=CC=C4N=C3SCCCC(=O)O

Isomeric SMILES

CC1=CC=CC2=C1C(=CC=C2)CN3C4=CC=CC=C4N=C3SCCCC(=O)O

InChI

InChI=1S/C23H22N2O2S/c1-16-7-4-8-17-9-5-10-18(22(16)17)15-25-20-12-3-2-11-19(20)24-23(25)28-14-6-13-21(26)27/h2-5,7-12H,6,13-15H2,1H3,(H,26,27)