1-phenyl-4-(2-phenylsulfanylethyl)piperazin-4-ium

Systemtic Name: 1-phenyl-4-(2-phenylsulfanylethyl)piperazin-4-ium Openeye Name: 1-phenyl-4-(2-phenylsulfanylethyl)piperazin-4-ium CAS Name: 1-phenyl-4-[2-(phenylthio)ethyl]piperazin-4-ium IUPAC Name: 1-phenyl-4-(2-phenylsulfanylethyl)piperazin-4-ium Traditional Name: 1-phenyl-4-[2-(phenylthio)ethyl]piperazin-4-ium Formula: C18H23N2S+ MolecularWeight: 299.45362

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCSC2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

C1CN(CC[NH+]1CCSC2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C18H22N2S/c1-3-7-17(8-4-1)20-13-11-19(12-14-20)15-16-21-18-9-5-2-6-10-18/h1-10H,11-16H2/p+1