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

Systemtic Name: sodium; 4-(2-butan-2-yloxyethoxy)-3-methyl-2H-pyridin-2-ide; 6-methoxy-2-methylsulfinyl-1H-benzimidazole Openeye Name: sodium; 6-methoxy-2-methylsulfinyl-1H-benzimidazole; 3-methyl-4-(2-sec-butoxyethoxy)-2H-pyridin-2-ide CAS Name: sodium; 4-(2-butan-2-yloxyethoxy)-3-methyl-2H-pyridin-2-ide; 6-methoxy-2-methylsulfinyl-1H-benzimidazole IUPAC Name: sodium; 4-(2-butan-2-yloxyethoxy)-3-methyl-2H-pyridin-2-ide; 6-methoxy-2-methylsulfinyl-1H-benzimidazole Traditional Name: sodium; 6-methoxy-2-methylsulfinyl-1H-benzimidazole; 3-methyl-4-(2-sec-butoxyethoxy)-2H-pyridin-2-ide Formula: C21H28N3NaO4S MolecularWeight: 441.51949

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)OCCOC1=CC=N[C-]=C1C.COC1=CC2=C(C=C1)N=C(N2)S(=O)C.[Na+]

Isomeric SMILES

CCC(C)OCCOC1=CC=N[C-]=C1C.COC1=CC2=C(C=C1)N=C(N2)S(=O)C.[Na+]

InChI

InChI=1S/C12H18NO2.C9H10N2O2S.Na/c1-4-11(3)14-7-8-15-12-5-6-13-9-10(12)2;1-13-6-3-4-7-8(5-6)11-9(10-7)14(2)12;/h5-6,11H,4,7-8H2,1-3H3;3-5H,1-2H3,(H,10,11);/q-1;;+1