2-[[3-methyl-4-(2-methylpropoxy)pyridin-2-yl]methylsulfanyl]-1H-benzimidazole

Systemtic Name: 2-[[3-methyl-4-(2-methylpropoxy)pyridin-2-yl]methylsulfanyl]-1H-benzimidazole Openeye Name: 2-[(4-isobutoxy-3-methyl-2-pyridyl)methylsulfanyl]-1H-benzimidazole CAS Name: 2-[[3-methyl-4-(2-methylpropoxy)-2-pyridinyl]methylthio]-1H-benzimidazole IUPAC Name: 2-[[3-methyl-4-(2-methylpropoxy)pyridin-2-yl]methylsulfanyl]-1H-benzimidazole Traditional Name: 2-[(4-isobutoxy-3-methyl-2-pyridyl)methylthio]-1H-benzimidazole Formula: C18H21N3OS MolecularWeight: 327.44384

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CN=C1CSC2=NC3=CC=CC=C3N2)OCC(C)C

Isomeric SMILES

CC1=C(C=CN=C1CSC2=NC3=CC=CC=C3N2)OCC(C)C

InChI

InChI=1S/C18H21N3OS/c1-12(2)10-22-17-8-9-19-16(13(17)3)11-23-18-20-14-6-4-5-7-15(14)21-18/h4-9,12H,10-11H2,1-3H3,(H,20,21)