(2,6-dimethylphenyl) 2-[2-[1-(phenylmethyl)benzimidazol-2-yl]sulfanylethanoyloxy]ethanoate

Systemtic Name: (2,6-dimethylphenyl) 2-[2-[1-(phenylmethyl)benzimidazol-2-yl]sulfanylethanoyloxy]ethanoate Openeye Name: (2,6-dimethylphenyl) 2-[2-(1-benzylbenzimidazol-2-yl)sulfanylacetyl]oxyacetate CAS Name: 2-[1-oxo-2-[[1-(phenylmethyl)-2-benzimidazolyl]thio]ethoxy]acetic acid (2,6-dimethylphenyl) ester IUPAC Name: (2,6-dimethylphenyl) 2-[2-(1-benzylbenzimidazol-2-yl)sulfanylacetyl]oxyacetate Traditional Name: 2-[2-[(1-benzylbenzimidazol-2-yl)thio]acetyl]oxyacetic acid (2,6-dimethylphenyl) ester Formula: C26H24N2O4S MolecularWeight: 460.54476

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)OC(=O)COC(=O)CSC2=NC3=CC=CC=C3N2CC4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=CC=C1)C)OC(=O)COC(=O)CSC2=NC3=CC=CC=C3N2CC4=CC=CC=C4

InChI

InChI=1S/C26H24N2O4S/c1-18-9-8-10-19(2)25(18)32-23(29)16-31-24(30)17-33-26-27-21-13-6-7-14-22(21)28(26)15-20-11-4-3-5-12-20/h3-14H,15-17H2,1-2H3