1-(3-chlorophenyl)-4-(3-phenylsulfanylpropyl)piperazin-4-ium

Systemtic Name: 1-(3-chlorophenyl)-4-(3-phenylsulfanylpropyl)piperazin-4-ium Openeye Name: 1-(3-chlorophenyl)-4-(3-phenylsulfanylpropyl)piperazin-4-ium CAS Name: 1-(3-chlorophenyl)-4-[3-(phenylthio)propyl]piperazin-4-ium IUPAC Name: 1-(3-chlorophenyl)-4-(3-phenylsulfanylpropyl)piperazin-4-ium Traditional Name: 1-(3-chlorophenyl)-4-[3-(phenylthio)propyl]piperazin-4-ium Formula: C19H24ClN2S+ MolecularWeight: 347.92526

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCCSC2=CC=CC=C2)C3=CC(=CC=C3)Cl

Isomeric SMILES

C1CN(CC[NH+]1CCCSC2=CC=CC=C2)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C19H23ClN2S/c20-17-6-4-7-18(16-17)22-13-11-21(12-14-22)10-5-15-23-19-8-2-1-3-9-19/h1-4,6-9,16H,5,10-15H2/p+1