sodium 2-[(4-methoxy-3-methyl-pyridin-2-yl)methylsulfinyl]-6-(trifluoromethyloxy)-1H-benzimidazole

Systemtic Name: sodium 2-[(4-methoxy-3-methyl-pyridin-2-yl)methylsulfinyl]-6-(trifluoromethyloxy)-1H-benzimidazole Openeye Name: sodium 2-[(4-methoxy-3-methyl-2-pyridyl)methylsulfinyl]-6-(trifluoromethoxy)-1H-benzimidazole CAS Name: sodium 2-[(4-methoxy-3-methyl-2-pyridinyl)methylsulfinyl]-6-(trifluoromethoxy)-1H-benzimidazole IUPAC Name: sodium 2-[(4-methoxy-3-methylpyridin-2-yl)methylsulfinyl]-6-(trifluoromethoxy)-1H-benzimidazole Traditional Name: sodium 2-[(4-methoxy-3-methyl-2-pyridyl)methylsulfinyl]-6-(trifluoromethoxy)-1H-benzimidazole Formula: C16H14F3N3NaO3S+ MolecularWeight: 408.35064

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CN=C1CS(=O)C2=NC3=C(N2)C=C(C=C3)OC(F)(F)F)OC.[Na+]

Isomeric SMILES

CC1=C(C=CN=C1CS(=O)C2=NC3=C(N2)C=C(C=C3)OC(F)(F)F)OC.[Na+]

InChI

InChI=1S/C16H14F3N3O3S.Na/c1-9-13(20-6-5-14(9)24-2)8-26(23)15-21-11-4-3-10(7-12(11)22-15)25-16(17,18)19;/h3-7H,8H2,1-2H3,(H,21,22);/q;+1