4-[(6-chloranyl-5-piperazin-1-yl-1H-benzimidazol-2-yl)sulfanyl]-2-methyl-pentan-2-ol dihydrochloride

Systemtic Name: 4-[(6-chloranyl-5-piperazin-1-yl-1H-benzimidazol-2-yl)sulfanyl]-2-methyl-pentan-2-ol dihydrochloride Openeye Name: 4-[(6-chloro-5-piperazin-1-yl-1H-benzimidazol-2-yl)sulfanyl]-2-methyl-pentan-2-ol dihydrochloride CAS Name: 4-[[6-chloro-5-(1-piperazinyl)-1H-benzimidazol-2-yl]thio]-2-methyl-2-pentanol dihydrochloride IUPAC Name: 4-[(6-chloro-5-piperazin-1-yl-1H-benzimidazol-2-yl)sulfanyl]-2-methylpentan-2-ol dihydrochloride Traditional Name: 4-[(6-chloro-5-piperazino-1H-benzimidazol-2-yl)thio]-2-methyl-pentan-2-ol dihydrochloride Formula: C17H27Cl3N4OS MolecularWeight: 441.84648

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(C)(C)O)SC1=NC2=CC(=C(C=C2N1)Cl)N3CCNCC3.Cl.Cl

Isomeric SMILES

CC(CC(C)(C)O)SC1=NC2=CC(=C(C=C2N1)Cl)N3CCNCC3.Cl.Cl

InChI

InChI=1S/C17H25ClN4OS.2ClH/c1-11(10-17(2,3)23)24-16-20-13-8-12(18)15(9-14(13)21-16)22-6-4-19-5-7-22;;/h8-9,11,19,23H,4-7,10H2,1-3H3,(H,20,21);2*1H