1-(2,6-dimethylphenyl)-5-[3-(4-methylpiperazin-4-ium-1-yl)propyl]-1,3,5-triazinane-2-thione

Systemtic Name: 1-(2,6-dimethylphenyl)-5-[3-(4-methylpiperazin-4-ium-1-yl)propyl]-1,3,5-triazinane-2-thione Openeye Name: 1-(2,6-dimethylphenyl)-5-[3-(4-methylpiperazin-4-ium-1-yl)propyl]-1,3,5-triazinane-2-thione CAS Name: 1-(2,6-dimethylphenyl)-5-[3-(4-methyl-1-piperazin-4-iumyl)propyl]-1,3,5-triazinane-2-thione IUPAC Name: 1-(2,6-dimethylphenyl)-5-[3-(4-methylpiperazin-4-ium-1-yl)propyl]-1,3,5-triazinane-2-thione Traditional Name: 1-(2,6-dimethylphenyl)-5-[3-(4-methylpiperazin-4-ium-1-yl)propyl]-1,3,5-triazinane-2-thione Formula: C19H32N5S+ MolecularWeight: 362.55588

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)N2CN(CNC2=S)CCCN3CC[NH+](CC3)C

Isomeric SMILES

CC1=C(C(=CC=C1)C)N2CN(CNC2=S)CCCN3CC[NH+](CC3)C

InChI

InChI=1S/C19H31N5S/c1-16-6-4-7-17(2)18(16)24-15-23(14-20-19(24)25)9-5-8-22-12-10-21(3)11-13-22/h4,6-7H,5,8-15H2,1-3H3,(H,20,25)/p+1