3-[[4-(4-ethanoylphenyl)piperazin-1-yl]carbothioylamino]propyl-dimethyl-azanium

Systemtic Name: 3-[[4-(4-ethanoylphenyl)piperazin-1-yl]carbothioylamino]propyl-dimethyl-azanium Openeye Name: 3-[[4-(4-acetylphenyl)piperazine-1-carbothioyl]amino]propyl-dimethyl-ammonium CAS Name: 3-[[[4-(4-acetylphenyl)-1-piperazinyl]-sulfanylidenemethyl]amino]propyl-dimethylammonium IUPAC Name: 3-[[4-(4-acetylphenyl)piperazine-1-carbothioyl]amino]propyl-dimethylazanium Traditional Name: 3-[[4-(4-acetylphenyl)piperazine-1-carbothioyl]amino]propyl-dimethyl-ammonium Formula: C18H29N4OS+ MolecularWeight: 349.51406

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H28N4OS/c1-15(23)16-5-7-17(8-6-16)21-11-13-22(14-12-21)18(24)19-9-4-10-20(2)3/h5-8H,4,9-14H2,1-3H3,(H,19,24)/p+1