2-[[4-(2-butan-2-yloxyethoxy)-3-methyl-pyridin-2-yl]methylsulfinyl]-1H-benzimidazole

Systemtic Name: 2-[[4-(2-butan-2-yloxyethoxy)-3-methyl-pyridin-2-yl]methylsulfinyl]-1H-benzimidazole Openeye Name: 2-[[3-methyl-4-(2-sec-butoxyethoxy)-2-pyridyl]methylsulfinyl]-1H-benzimidazole CAS Name: 2-[[4-(2-butan-2-yloxyethoxy)-3-methyl-2-pyridinyl]methylsulfinyl]-1H-benzimidazole IUPAC Name: 2-[[4-(2-butan-2-yloxyethoxy)-3-methylpyridin-2-yl]methylsulfinyl]-1H-benzimidazole Traditional Name: 2-[[3-methyl-4-(2-sec-butoxyethoxy)-2-pyridyl]methylsulfinyl]-1H-benzimidazole Formula: C20H25N3O3S MolecularWeight: 387.4958

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)OCCOC1=C(C(=NC=C1)CS(=O)C2=NC3=CC=CC=C3N2)C

Isomeric SMILES

CCC(C)OCCOC1=C(C(=NC=C1)CS(=O)C2=NC3=CC=CC=C3N2)C

InChI

InChI=1S/C20H25N3O3S/c1-4-14(2)25-11-12-26-19-9-10-21-18(15(19)3)13-27(24)20-22-16-7-5-6-8-17(16)23-20/h5-10,14H,4,11-13H2,1-3H3,(H,22,23)