1-[(4-methylsulfanylphenyl)methyl]-4-(naphthalen-1-ylmethyl)piperazine-1,4-diium

Systemtic Name: 1-[(4-methylsulfanylphenyl)methyl]-4-(naphthalen-1-ylmethyl)piperazine-1,4-diium Openeye Name: 1-[(4-methylsulfanylphenyl)methyl]-4-(1-naphthylmethyl)piperazine-1,4-diium CAS Name: 1-[[4-(methylthio)phenyl]methyl]-4-(1-naphthalenylmethyl)piperazine-1,4-diium IUPAC Name: 1-[(4-methylsulfanylphenyl)methyl]-4-(naphthalen-1-ylmethyl)piperazine-1,4-diium Traditional Name: 1-[4-(methylthio)benzyl]-4-(1-naphthylmethyl)piperazine-1,4-diium Formula: C23H28N2S+2 MolecularWeight: 364.54682

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C[NH+]2CC[NH+](CC2)CC3=CC=CC4=CC=CC=C43

Isomeric SMILES

CSC1=CC=C(C=C1)C[NH+]2CC[NH+](CC2)CC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C23H26N2S/c1-26-22-11-9-19(10-12-22)17-24-13-15-25(16-14-24)18-21-7-4-6-20-5-2-3-8-23(20)21/h2-12H,13-18H2,1H3/p+2