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

Systemtic Name: 1-cyclopentyl-4-[(4-methylsulfanylphenyl)methyl]piperazine-1,4-diium Openeye Name: 1-cyclopentyl-4-[(4-methylsulfanylphenyl)methyl]piperazine-1,4-diium CAS Name: 1-cyclopentyl-4-[[4-(methylthio)phenyl]methyl]piperazine-1,4-diium IUPAC Name: 1-cyclopentyl-4-[(4-methylsulfanylphenyl)methyl]piperazine-1,4-diium Traditional Name: 1-cyclopentyl-4-[4-(methylthio)benzyl]piperazine-1,4-diium Formula: C17H28N2S+2 MolecularWeight: 292.48262

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C[NH+]2CC[NH+](CC2)C3CCCC3

Isomeric SMILES

CSC1=CC=C(C=C1)C[NH+]2CC[NH+](CC2)C3CCCC3

InChI

InChI=1S/C17H26N2S/c1-20-17-8-6-15(7-9-17)14-18-10-12-19(13-11-18)16-4-2-3-5-16/h6-9,16H,2-5,10-14H2,1H3/p+2