2-[1-(3,4,5-trimethylpyridin-2-yl)ethylsulfanyl]-1H-benzimidazole

Systemtic Name: 2-[1-(3,4,5-trimethylpyridin-2-yl)ethylsulfanyl]-1H-benzimidazole Openeye Name: 2-[1-(3,4,5-trimethyl-2-pyridyl)ethylsulfanyl]-1H-benzimidazole CAS Name: 2-[1-(3,4,5-trimethyl-2-pyridinyl)ethylthio]-1H-benzimidazole IUPAC Name: 2-[1-(3,4,5-trimethylpyridin-2-yl)ethylsulfanyl]-1H-benzimidazole Traditional Name: 2-[1-(3,4,5-trimethyl-2-pyridyl)ethylthio]-1H-benzimidazole Formula: C17H19N3S MolecularWeight: 297.41786

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(C(=C1C)C)C(C)SC2=NC3=CC=CC=C3N2

Isomeric SMILES

CC1=CN=C(C(=C1C)C)C(C)SC2=NC3=CC=CC=C3N2

InChI

InChI=1S/C17H19N3S/c1-10-9-18-16(12(3)11(10)2)13(4)21-17-19-14-7-5-6-8-15(14)20-17/h5-9,13H,1-4H3,(H,19,20)