2-[[3-[bis(propylsulfanyl)methyl]phenoxy]methyl]-1H-benzimidazole hydrochloride

Systemtic Name: 2-[[3-[bis(propylsulfanyl)methyl]phenoxy]methyl]-1H-benzimidazole hydrochloride Openeye Name: 2-[[3-[bis(propylsulfanyl)methyl]phenoxy]methyl]-1H-benzimidazole hydrochloride CAS Name: 2-[[3-[bis(propylthio)methyl]phenoxy]methyl]-1H-benzimidazole hydrochloride IUPAC Name: 2-[[3-[bis(propylsulfanyl)methyl]phenoxy]methyl]-1H-benzimidazole hydrochloride Traditional Name: 2-[[3-[bis(propylthio)methyl]phenoxy]methyl]-1H-benzimidazole hydrochloride Formula: C21H27ClN2OS2 MolecularWeight: 423.03488

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC(C1=CC(=CC=C1)OCC2=NC3=CC=CC=C3N2)SCCC.Cl

Isomeric SMILES

CCCSC(C1=CC(=CC=C1)OCC2=NC3=CC=CC=C3N2)SCCC.Cl

InChI

InChI=1S/C21H26N2OS2.ClH/c1-3-12-25-21(26-13-4-2)16-8-7-9-17(14-16)24-15-20-22-18-10-5-6-11-19(18)23-20;/h5-11,14,21H,3-4,12-13,15H2,1-2H3,(H,22,23);1H