1-[[(1S)-cyclohex-3-en-1-yl]methyl]-4-[(4-methylsulfanylphenyl)methyl]piperazin-1-ium

Systemtic Name: 1-[[(1S)-cyclohex-3-en-1-yl]methyl]-4-[(4-methylsulfanylphenyl)methyl]piperazin-1-ium Openeye Name: 1-[[(1S)-cyclohex-3-en-1-yl]methyl]-4-[(4-methylsulfanylphenyl)methyl]piperazin-1-ium CAS Name: 1-[[(1S)-1-cyclohex-3-enyl]methyl]-4-[[4-(methylthio)phenyl]methyl]piperazin-1-ium IUPAC Name: 1-[[(1S)-cyclohex-3-en-1-yl]methyl]-4-[(4-methylsulfanylphenyl)methyl]piperazin-1-ium Traditional Name: 1-[[(1S)-cyclohex-3-en-1-yl]methyl]-4-[4-(methylthio)benzyl]piperazin-1-ium Formula: C19H29N2S+ MolecularWeight: 317.51196

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)CN2CC[NH+](CC2)CC3CCC=CC3

Isomeric SMILES

CSC1=CC=C(C=C1)CN2CC[NH+](CC2)C[C@H]3CCC=CC3

InChI

InChI=1S/C19H28N2S/c1-22-19-9-7-18(8-10-19)16-21-13-11-20(12-14-21)15-17-5-3-2-4-6-17/h2-3,7-10,17H,4-6,11-16H2,1H3/p+1/t17-/m1/s1