1-oxidanyl-2-pentan-2-ylsulfanyl-benzimidazole dihydrochloride

Systemtic Name: 1-oxidanyl-2-pentan-2-ylsulfanyl-benzimidazole dihydrochloride Openeye Name: 1-hydroxy-2-(1-methylbutylsulfanyl)benzimidazole dihydrochloride CAS Name: 1-hydroxy-2-(pentan-2-ylthio)benzimidazole dihydrochloride IUPAC Name: 1-hydroxy-2-pentan-2-ylsulfanylbenzimidazole dihydrochloride Traditional Name: 1-hydroxy-2-(1-methylbutylthio)benzimidazole dihydrochloride Formula: C12H18Cl2N2OS MolecularWeight: 309.25512

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)SC1=NC2=CC=CC=C2N1O.Cl.Cl

Isomeric SMILES

CCCC(C)SC1=NC2=CC=CC=C2N1O.Cl.Cl

InChI

InChI=1S/C12H16N2OS.2ClH/c1-3-6-9(2)16-12-13-10-7-4-5-8-11(10)14(12)15;;/h4-5,7-9,15H,3,6H2,1-2H3;2*1H