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

Systemtic Name: dimethyl-[3-[[4-(phenylcarbonyl)piperazin-1-yl]carbothioylamino]propyl]azanium Openeye Name: 3-[(4-benzoylpiperazine-1-carbothioyl)amino]propyl-dimethyl-ammonium CAS Name: 3-[[(4-benzoyl-1-piperazinyl)-sulfanylidenemethyl]amino]propyl-dimethylammonium IUPAC Name: 3-[(4-benzoylpiperazine-1-carbothioyl)amino]propyl-dimethylazanium Traditional Name: 3-[(4-benzoylpiperazine-1-carbothioyl)amino]propyl-dimethyl-ammonium Formula: C17H27N4OS+ MolecularWeight: 335.48748

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCNC(=S)N1CCN(CC1)C(=O)C2=CC=CC=C2

Isomeric SMILES

C[NH+](C)CCCNC(=S)N1CCN(CC1)C(=O)C2=CC=CC=C2

InChI

InChI=1S/C17H26N4OS/c1-19(2)10-6-9-18-17(23)21-13-11-20(12-14-21)16(22)15-7-4-3-5-8-15/h3-5,7-8H,6,9-14H2,1-2H3,(H,18,23)/p+1