2-[(4-ethoxy-3-methyl-pyridin-2-yl)methylsulfinyl]-6-(trifluoromethyl)-1H-benzimidazole

Systemtic Name: 2-[(4-ethoxy-3-methyl-pyridin-2-yl)methylsulfinyl]-6-(trifluoromethyl)-1H-benzimidazole Openeye Name: 2-[(4-ethoxy-3-methyl-2-pyridyl)methylsulfinyl]-6-(trifluoromethyl)-1H-benzimidazole CAS Name: 2-[(4-ethoxy-3-methyl-2-pyridinyl)methylsulfinyl]-6-(trifluoromethyl)-1H-benzimidazole IUPAC Name: 2-[(4-ethoxy-3-methylpyridin-2-yl)methylsulfinyl]-6-(trifluoromethyl)-1H-benzimidazole Traditional Name: 2-[(4-ethoxy-3-methyl-2-pyridyl)methylsulfinyl]-6-(trifluoromethyl)-1H-benzimidazole Formula: C17H16F3N3O2S MolecularWeight: 383.38805

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=NC=C1)CS(=O)C2=NC3=C(N2)C=C(C=C3)C(F)(F)F)C

Isomeric SMILES

CCOC1=C(C(=NC=C1)CS(=O)C2=NC3=C(N2)C=C(C=C3)C(F)(F)F)C

InChI

InChI=1S/C17H16F3N3O2S/c1-3-25-15-6-7-21-14(10(15)2)9-26(24)16-22-12-5-4-11(17(18,19)20)8-13(12)23-16/h4-8H,3,9H2,1-2H3,(H,22,23)