2-methyl-3-[(6-piperazin-1-yl-1H-benzimidazol-2-yl)sulfanylmethyl]pentan-2-ol dihydrochloride

Systemtic Name: 2-methyl-3-[(6-piperazin-1-yl-1H-benzimidazol-2-yl)sulfanylmethyl]pentan-2-ol dihydrochloride Openeye Name: 2-methyl-3-[(6-piperazin-1-yl-1H-benzimidazol-2-yl)sulfanylmethyl]pentan-2-ol dihydrochloride CAS Name: 2-methyl-3-[[[6-(1-piperazinyl)-1H-benzimidazol-2-yl]thio]methyl]-2-pentanol dihydrochloride IUPAC Name: 2-methyl-3-[(6-piperazin-1-yl-1H-benzimidazol-2-yl)sulfanylmethyl]pentan-2-ol dihydrochloride Traditional Name: 2-methyl-3-[[(6-piperazino-1H-benzimidazol-2-yl)thio]methyl]pentan-2-ol dihydrochloride Formula: C18H30Cl2N4OS MolecularWeight: 421.428

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CSC1=NC2=C(N1)C=C(C=C2)N3CCNCC3)C(C)(C)O.Cl.Cl

Isomeric SMILES

CCC(CSC1=NC2=C(N1)C=C(C=C2)N3CCNCC3)C(C)(C)O.Cl.Cl

InChI

InChI=1S/C18H28N4OS.2ClH/c1-4-13(18(2,3)23)12-24-17-20-15-6-5-14(11-16(15)21-17)22-9-7-19-8-10-22;;/h5-6,11,13,19,23H,4,7-10,12H2,1-3H3,(H,20,21);2*1H