2-[[4-(2-chlorophenyl)carbonylpiperazin-1-yl]carbothioylamino]ethyl-dimethyl-azanium

Systemtic Name: 2-[[4-(2-chlorophenyl)carbonylpiperazin-1-yl]carbothioylamino]ethyl-dimethyl-azanium Openeye Name: 2-[[4-(2-chlorobenzoyl)piperazine-1-carbothioyl]amino]ethyl-dimethyl-ammonium CAS Name: 2-[[[4-[(2-chlorophenyl)-oxomethyl]-1-piperazinyl]-sulfanylidenemethyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[[4-(2-chlorobenzoyl)piperazine-1-carbothioyl]amino]ethyl-dimethylazanium Traditional Name: 2-[[4-(2-chlorobenzoyl)piperazine-1-carbothioyl]amino]ethyl-dimethyl-ammonium Formula: C16H24ClN4OS+ MolecularWeight: 355.90596

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCNC(=S)N1CCN(CC1)C(=O)C2=CC=CC=C2Cl

Isomeric SMILES

C[NH+](C)CCNC(=S)N1CCN(CC1)C(=O)C2=CC=CC=C2Cl

InChI

InChI=1S/C16H23ClN4OS/c1-19(2)8-7-18-16(23)21-11-9-20(10-12-21)15(22)13-5-3-4-6-14(13)17/h3-6H,7-12H2,1-2H3,(H,18,23)/p+1