1-[3-(4-chlorophenyl)sulfinylpropyl]-4-phenethyl-piperazine dihydrochloride

Systemtic Name: 1-[3-(4-chlorophenyl)sulfinylpropyl]-4-phenethyl-piperazine dihydrochloride Openeye Name: 1-[3-(4-chlorophenyl)sulfinylpropyl]-4-phenethyl-piperazine dihydrochloride CAS Name: 1-[3-(4-chlorophenyl)sulfinylpropyl]-4-phenethylpiperazine dihydrochloride IUPAC Name: 1-[3-(4-chlorophenyl)sulfinylpropyl]-4-phenethylpiperazine dihydrochloride Traditional Name: 1-[3-(4-chlorophenyl)sulfinylpropyl]-4-phenethyl-piperazine dihydrochloride Formula: C21H29Cl3N2OS MolecularWeight: 463.89176

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCS(=O)C2=CC=C(C=C2)Cl)CCC3=CC=CC=C3.Cl.Cl

Isomeric SMILES

C1CN(CCN1CCCS(=O)C2=CC=C(C=C2)Cl)CCC3=CC=CC=C3.Cl.Cl

InChI

InChI=1S/C21H27ClN2OS.2ClH/c22-20-7-9-21(10-8-20)26(25)18-4-12-23-14-16-24(17-15-23)13-11-19-5-2-1-3-6-19;;/h1-3,5-10H,4,11-18H2;2*1H