2-[(3,4-dimethylpyridin-2-yl)methylsulfinyl]-1-(phenylsulfonyl)benzimidazole

Systemtic Name: 2-[(3,4-dimethylpyridin-2-yl)methylsulfinyl]-1-(phenylsulfonyl)benzimidazole Openeye Name: 1-(benzenesulfonyl)-2-[(3,4-dimethyl-2-pyridyl)methylsulfinyl]benzimidazole CAS Name: 1-(benzenesulfonyl)-2-[(3,4-dimethyl-2-pyridinyl)methylsulfinyl]benzimidazole IUPAC Name: 1-(benzenesulfonyl)-2-[(3,4-dimethylpyridin-2-yl)methylsulfinyl]benzimidazole Traditional Name: 1-besyl-2-[(3,4-dimethyl-2-pyridyl)methylsulfinyl]benzimidazole Formula: C21H19N3O3S2 MolecularWeight: 425.52386

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC=C1)CS(=O)C2=NC3=CC=CC=C3N2S(=O)(=O)C4=CC=CC=C4)C

Isomeric SMILES

CC1=C(C(=NC=C1)CS(=O)C2=NC3=CC=CC=C3N2S(=O)(=O)C4=CC=CC=C4)C

InChI

InChI=1S/C21H19N3O3S2/c1-15-12-13-22-19(16(15)2)14-28(25)21-23-18-10-6-7-11-20(18)24(21)29(26,27)17-8-4-3-5-9-17/h3-13H,14H2,1-2H3