2-[[4-(2,3-dimethylphenyl)piperazin-1-yl]carbothioylamino]ethyl-dimethyl-azanium

Systemtic Name: 2-[[4-(2,3-dimethylphenyl)piperazin-1-yl]carbothioylamino]ethyl-dimethyl-azanium Openeye Name: 2-[[4-(2,3-dimethylphenyl)piperazine-1-carbothioyl]amino]ethyl-dimethyl-ammonium CAS Name: 2-[[[4-(2,3-dimethylphenyl)-1-piperazinyl]-sulfanylidenemethyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[[4-(2,3-dimethylphenyl)piperazine-1-carbothioyl]amino]ethyl-dimethylazanium Traditional Name: 2-[[4-(2,3-dimethylphenyl)piperazine-1-carbothioyl]amino]ethyl-dimethyl-ammonium Formula: C17H29N4S+ MolecularWeight: 321.50396

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H28N4S/c1-14-6-5-7-16(15(14)2)20-10-12-21(13-11-20)17(22)18-8-9-19(3)4/h5-7H,8-13H2,1-4H3,(H,18,22)/p+1