(6-pyridin-3-ylsulfanyl-1H-benzimidazol-2-yl)methanol dihydrochloride

Systemtic Name: (6-pyridin-3-ylsulfanyl-1H-benzimidazol-2-yl)methanol dihydrochloride Openeye Name: [6-(3-pyridylsulfanyl)-1H-benzimidazol-2-yl]methanol dihydrochloride CAS Name: [6-(3-pyridinylthio)-1H-benzimidazol-2-yl]methanol dihydrochloride IUPAC Name: (6-pyridin-3-ylsulfanyl-1H-benzimidazol-2-yl)methanol dihydrochloride Traditional Name: [6-(3-pyridylthio)-1H-benzimidazol-2-yl]methanol dihydrochloride Formula: C13H13Cl2N3OS MolecularWeight: 330.23282

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)SC2=CC3=C(C=C2)N=C(N3)CO.Cl.Cl

Isomeric SMILES

C1=CC(=CN=C1)SC2=CC3=C(C=C2)N=C(N3)CO.Cl.Cl

InChI

InChI=1S/C13H11N3OS.2ClH/c17-8-13-15-11-4-3-9(6-12(11)16-13)18-10-2-1-5-14-7-10;;/h1-7,17H,8H2,(H,15,16);2*1H