dimethyl-[3-[[4-[(3-methylphenyl)methyl]piperazin-4-ium-1-yl]carbothioylamino]propyl]azanium

Systemtic Name: dimethyl-[3-[[4-[(3-methylphenyl)methyl]piperazin-4-ium-1-yl]carbothioylamino]propyl]azanium Openeye Name: dimethyl-[3-[[4-(m-tolylmethyl)piperazin-4-ium-1-carbothioyl]amino]propyl]ammonium CAS Name: dimethyl-[3-[[[4-[(3-methylphenyl)methyl]-1-piperazin-4-iumyl]-sulfanylidenemethyl]amino]propyl]ammonium IUPAC Name: dimethyl-[3-[[4-[(3-methylphenyl)methyl]piperazin-4-ium-1-carbothioyl]amino]propyl]azanium Traditional Name: dimethyl-[3-[[4-(3-methylbenzyl)piperazin-4-ium-1-carbothioyl]amino]propyl]ammonium Formula: C18H32N4S+2 MolecularWeight: 336.53848

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)C[NH+]2CCN(CC2)C(=S)NCCC[NH+](C)C

Isomeric SMILES

CC1=CC(=CC=C1)C[NH+]2CCN(CC2)C(=S)NCCC[NH+](C)C

InChI

InChI=1S/C18H30N4S/c1-16-6-4-7-17(14-16)15-21-10-12-22(13-11-21)18(23)19-8-5-9-20(2)3/h4,6-7,14H,5,8-13,15H2,1-3H3,(H,19,23)/p+2