2-[(3-methoxyphenoxy)methyl]-6-(2-methylsulfonylphenyl)-1H-benzimidazole

Systemtic Name: 2-[(3-methoxyphenoxy)methyl]-6-(2-methylsulfonylphenyl)-1H-benzimidazole Openeye Name: 2-[(3-methoxyphenoxy)methyl]-6-(2-methylsulfonylphenyl)-1H-benzimidazole CAS Name: 2-[(3-methoxyphenoxy)methyl]-6-(2-methylsulfonylphenyl)-1H-benzimidazole IUPAC Name: 2-[(3-methoxyphenoxy)methyl]-6-(2-methylsulfonylphenyl)-1H-benzimidazole Traditional Name: 6-(2-mesylphenyl)-2-[(3-methoxyphenoxy)methyl]-1H-benzimidazole Formula: C22H20N2O4S MolecularWeight: 408.4702

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC=C1)OCC2=NC3=C(N2)C=C(C=C3)C4=CC=CC=C4S(=O)(=O)C

Isomeric SMILES

COC1=CC(=CC=C1)OCC2=NC3=C(N2)C=C(C=C3)C4=CC=CC=C4S(=O)(=O)C

InChI

InChI=1S/C22H20N2O4S/c1-27-16-6-5-7-17(13-16)28-14-22-23-19-11-10-15(12-20(19)24-22)18-8-3-4-9-21(18)29(2,25)26/h3-13H,14H2,1-2H3,(H,23,24)