6-chloranyl-2-(5-methylhexylsulfanyl)-5-piperazin-1-yl-1H-benzimidazole dihydrochloride

Systemtic Name: 6-chloranyl-2-(5-methylhexylsulfanyl)-5-piperazin-1-yl-1H-benzimidazole dihydrochloride Openeye Name: 6-chloro-2-(5-methylhexylsulfanyl)-5-piperazin-1-yl-1H-benzimidazole dihydrochloride CAS Name: 6-chloro-2-(5-methylhexylthio)-5-(1-piperazinyl)-1H-benzimidazole dihydrochloride IUPAC Name: 6-chloro-2-(5-methylhexylsulfanyl)-5-piperazin-1-yl-1H-benzimidazole dihydrochloride Traditional Name: 6-chloro-2-(5-methylhexylthio)-5-piperazino-1H-benzimidazole dihydrochloride Formula: C18H29Cl3N4S MolecularWeight: 439.87366

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCSC1=NC2=CC(=C(C=C2N1)Cl)N3CCNCC3.Cl.Cl

Isomeric SMILES

CC(C)CCCCSC1=NC2=CC(=C(C=C2N1)Cl)N3CCNCC3.Cl.Cl

InChI

InChI=1S/C18H27ClN4S.2ClH/c1-13(2)5-3-4-10-24-18-21-15-11-14(19)17(12-16(15)22-18)23-8-6-20-7-9-23;;/h11-13,20H,3-10H2,1-2H3,(H,21,22);2*1H