dimethyl-[3-[[4-(4-methylphenyl)sulfonylpiperazin-1-yl]carbothioylamino]propyl]azanium

Systemtic Name: dimethyl-[3-[[4-(4-methylphenyl)sulfonylpiperazin-1-yl]carbothioylamino]propyl]azanium Openeye Name: dimethyl-[3-[[4-(p-tolylsulfonyl)piperazine-1-carbothioyl]amino]propyl]ammonium CAS Name: dimethyl-[3-[[[4-(4-methylphenyl)sulfonyl-1-piperazinyl]-sulfanylidenemethyl]amino]propyl]ammonium IUPAC Name: dimethyl-[3-[[4-(4-methylphenyl)sulfonylpiperazine-1-carbothioyl]amino]propyl]azanium Traditional Name: dimethyl-[3-[(4-tosylpiperazine-1-carbothioyl)amino]propyl]ammonium Formula: C17H29N4O2S2+ MolecularWeight: 385.56776

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=S)NCCC[NH+](C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=S)NCCC[NH+](C)C

InChI

InChI=1S/C17H28N4O2S2/c1-15-5-7-16(8-6-15)25(22,23)21-13-11-20(12-14-21)17(24)18-9-4-10-19(2)3/h5-8H,4,9-14H2,1-3H3,(H,18,24)/p+1