sodium; 4-(2-butan-2-yloxyethoxy)-3-methyl-2H-pyridin-2-ide; 2-methylsulfinyl-6-(trifluoromethyl)-1H-benzimidazole

Systemtic Name: sodium; 4-(2-butan-2-yloxyethoxy)-3-methyl-2H-pyridin-2-ide; 2-methylsulfinyl-6-(trifluoromethyl)-1H-benzimidazole Openeye Name: sodium; 3-methyl-4-(2-sec-butoxyethoxy)-2H-pyridin-2-ide; 2-methylsulfinyl-6-(trifluoromethyl)-1H-benzimidazole CAS Name: sodium; 4-(2-butan-2-yloxyethoxy)-3-methyl-2H-pyridin-2-ide; 2-methylsulfinyl-6-(trifluoromethyl)-1H-benzimidazole IUPAC Name: sodium; 4-(2-butan-2-yloxyethoxy)-3-methyl-2H-pyridin-2-ide; 2-methylsulfinyl-6-(trifluoromethyl)-1H-benzimidazole Traditional Name: sodium; 3-methyl-4-(2-sec-butoxyethoxy)-2H-pyridin-2-ide; 2-methylsulfinyl-6-(trifluoromethyl)-1H-benzimidazole Formula: C21H25F3N3NaO3S MolecularWeight: 479.49148

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)OCCOC1=CC=N[C-]=C1C.CS(=O)C1=NC2=C(N1)C=C(C=C2)C(F)(F)F.[Na+]

Isomeric SMILES

CCC(C)OCCOC1=CC=N[C-]=C1C.CS(=O)C1=NC2=C(N1)C=C(C=C2)C(F)(F)F.[Na+]

InChI

InChI=1S/C12H18NO2.C9H7F3N2OS.Na/c1-4-11(3)14-7-8-15-12-5-6-13-9-10(12)2;1-16(15)8-13-6-3-2-5(9(10,11)12)4-7(6)14-8;/h5-6,11H,4,7-8H2,1-3H3;2-4H,1H3,(H,13,14);/q-1;;+1