1-[(4-methylsulfanylphenyl)methyl]-4-phenyl-piperazin-1-ium

Systemtic Name: 1-[(4-methylsulfanylphenyl)methyl]-4-phenyl-piperazin-1-ium Openeye Name: 1-[(4-methylsulfanylphenyl)methyl]-4-phenyl-piperazin-1-ium CAS Name: 1-[[4-(methylthio)phenyl]methyl]-4-phenylpiperazin-1-ium IUPAC Name: 1-[(4-methylsulfanylphenyl)methyl]-4-phenylpiperazin-1-ium Traditional Name: 1-[4-(methylthio)benzyl]-4-phenyl-piperazin-1-ium Formula: C18H23N2S+ MolecularWeight: 299.45362

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C[NH+]2CCN(CC2)C3=CC=CC=C3

Isomeric SMILES

CSC1=CC=C(C=C1)C[NH+]2CCN(CC2)C3=CC=CC=C3

InChI

InChI=1S/C18H22N2S/c1-21-18-9-7-16(8-10-18)15-19-11-13-20(14-12-19)17-5-3-2-4-6-17/h2-10H,11-15H2,1H3/p+1