N-[5-(dimethylsulfamoyl)-2-methyl-phenyl]-4-ethyl-piperazin-4-ium-1-carbothioamide

Systemtic Name: N-[5-(dimethylsulfamoyl)-2-methyl-phenyl]-4-ethyl-piperazin-4-ium-1-carbothioamide Openeye Name: N-[5-(dimethylsulfamoyl)-2-methyl-phenyl]-4-ethyl-piperazin-4-ium-1-carbothioamide CAS Name: N-[5-(dimethylsulfamoyl)-2-methylphenyl]-4-ethyl-1-piperazin-4-iumcarbothioamide IUPAC Name: N-[5-(dimethylsulfamoyl)-2-methylphenyl]-4-ethylpiperazin-4-ium-1-carbothioamide Traditional Name: N-[5-(dimethylsulfamoyl)-2-methyl-phenyl]-4-ethyl-piperazin-4-ium-1-carbothioamide Formula: C16H27N4O2S2+ MolecularWeight: 371.54118

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C(=S)NC2=C(C=CC(=C2)S(=O)(=O)N(C)C)C

Isomeric SMILES

CC[NH+]1CCN(CC1)C(=S)NC2=C(C=CC(=C2)S(=O)(=O)N(C)C)C

InChI

InChI=1S/C16H26N4O2S2/c1-5-19-8-10-20(11-9-19)16(23)17-15-12-14(7-6-13(15)2)24(21,22)18(3)4/h6-7,12H,5,8-11H2,1-4H3,(H,17,23)/p+1