1-methyl-4-[4-(2-phenylsulfanylphenoxy)butyl]piperazine dihydrochloride

Systemtic Name: 1-methyl-4-[4-(2-phenylsulfanylphenoxy)butyl]piperazine dihydrochloride Openeye Name: 1-methyl-4-[4-(2-phenylsulfanylphenoxy)butyl]piperazine dihydrochloride CAS Name: 1-methyl-4-[4-[2-(phenylthio)phenoxy]butyl]piperazine dihydrochloride IUPAC Name: 1-methyl-4-[4-(2-phenylsulfanylphenoxy)butyl]piperazine dihydrochloride Traditional Name: 1-methyl-4-[4-[2-(phenylthio)phenoxy]butyl]piperazine dihydrochloride Formula: C21H30Cl2N2OS MolecularWeight: 429.4467

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CCCCOC2=CC=CC=C2SC3=CC=CC=C3.Cl.Cl

Isomeric SMILES

CN1CCN(CC1)CCCCOC2=CC=CC=C2SC3=CC=CC=C3.Cl.Cl

InChI

InChI=1S/C21H28N2OS.2ClH/c1-22-14-16-23(17-15-22)13-7-8-18-24-20-11-5-6-12-21(20)25-19-9-3-2-4-10-19;;/h2-6,9-12H,7-8,13-18H2,1H3;2*1H