4-[[6-[4-(2-hydroxyethyl)piperazin-1-yl]-1H-benzimidazol-2-yl]sulfanyl]-2-methyl-hexan-2-ol dihydrochloride

Systemtic Name: 4-[[6-[4-(2-hydroxyethyl)piperazin-1-yl]-1H-benzimidazol-2-yl]sulfanyl]-2-methyl-hexan-2-ol dihydrochloride Openeye Name: 4-[[6-[4-(2-hydroxyethyl)piperazin-1-yl]-1H-benzimidazol-2-yl]sulfanyl]-2-methyl-hexan-2-ol dihydrochloride CAS Name: 4-[[6-[4-(2-hydroxyethyl)-1-piperazinyl]-1H-benzimidazol-2-yl]thio]-2-methyl-2-hexanol dihydrochloride IUPAC Name: 4-[[6-[4-(2-hydroxyethyl)piperazin-1-yl]-1H-benzimidazol-2-yl]sulfanyl]-2-methylhexan-2-ol dihydrochloride Traditional Name: 4-[[6-[4-(2-hydroxyethyl)piperazino]-1H-benzimidazol-2-yl]thio]-2-methyl-hexan-2-ol dihydrochloride Formula: C20H34Cl2N4O2S MolecularWeight: 465.48056

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CC(C)(C)O)SC1=NC2=C(N1)C=C(C=C2)N3CCN(CC3)CCO.Cl.Cl

Isomeric SMILES

CCC(CC(C)(C)O)SC1=NC2=C(N1)C=C(C=C2)N3CCN(CC3)CCO.Cl.Cl

InChI

InChI=1S/C20H32N4O2S.2ClH/c1-4-16(14-20(2,3)26)27-19-21-17-6-5-15(13-18(17)22-19)24-9-7-23(8-10-24)11-12-25;;/h5-6,13,16,25-26H,4,7-12,14H2,1-3H3,(H,21,22);2*1H