N'-Methyl-N-[5-Methyl-2-(2-Methyl-2-Propanyl)-1,3-Benzothiazol-6-Yl]-1-Piperazinecarbothiohydrazide

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Properties Simple | Detailed

Formula C18H27N5S2
IUPAC Name n-(2-tert-butyl-5-methyl-1,3-benzothiazol-6-yl)-n'-methyl-piperazine-1-carbothiohydrazide
Molecular Mass 377.570 g·mol−1
Heat of Formation 315.8 ± 16.7 kJ·mol−1
Dipole Moment 4.99 ± 1.08 D
Volume 465.33 Å 3
Surface Area 382.06 Å 2
HOMO Energy -8.01 ± 0.55 eV
LUMO Energy -0.84 ± eV
Point Group Symmetry C1
Synonyms
  • 1-piperazinecarbothioic acid, 1-(2-(1,1-dimethylethyl)-5-methyl-6-benzothiazolyl)-2-methylhydrazide
  • cgp 21833
  • cgp-21833
  • n-(2-tert-butyl-5-methyl-1,3-benzothiazol-6-yl)-n'-methyl-1-piperazinecarbothiohydrazide
  • n-(2-tert-butyl-5-methyl-1,3-benzothiazol-6-yl)-n'-methyl-piperazine-1-carbothiohydrazide
  • n-(2-tert-butyl-5-methyl-1,3-benzothiazol-6-yl)-n'-methylpiperazine-1-carbothiohydrazide
CAS Number(s)
  • 122378-49-8
InChIKey UHZLKFSNWANYEJ-UHFFFAOYSA-N
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