2-[2-[2-(2,6-dimethylphenoxy)ethylsulfanyl]benzimidazol-1-yl]ethanoate

Systemtic Name: 2-[2-[2-(2,6-dimethylphenoxy)ethylsulfanyl]benzimidazol-1-yl]ethanoate Openeye Name: 2-[2-[2-(2,6-dimethylphenoxy)ethylsulfanyl]benzimidazol-1-yl]acetate CAS Name: 2-[2-[2-(2,6-dimethylphenoxy)ethylthio]-1-benzimidazolyl]acetate IUPAC Name: 2-[2-[2-(2,6-dimethylphenoxy)ethylsulfanyl]benzimidazol-1-yl]acetate Traditional Name: 2-[2-[2-(2,6-dimethylphenoxy)ethylthio]benzimidazol-1-yl]acetate Formula: C19H19N2O3S- MolecularWeight: 355.43076

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)OCCSC2=NC3=CC=CC=C3N2CC(=O)[O-]

Isomeric SMILES

CC1=C(C(=CC=C1)C)OCCSC2=NC3=CC=CC=C3N2CC(=O)[O-]

InChI

InChI=1S/C19H20N2O3S/c1-13-6-5-7-14(2)18(13)24-10-11-25-19-20-15-8-3-4-9-16(15)21(19)12-17(22)23/h3-9H,10-12H2,1-2H3,(H,22,23)/p-1