4-Methyl-N-[4-[(4-Nitrophenyl)Amino]Phenyl]-1-Piperazinecarbothioamide

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Properties Simple | Detailed

Formula C18H21N5O2S
IUPAC Name 4-methyl-n-[4-(4-nitroanilino)phenyl]piperazine-1-carbothioamide
Molecular Mass 371.457 g·mol−1
Heat of Formation 298.3 ± 16.7 kJ·mol−1
Dipole Moment 5.49 ± 1.08 D
Volume 435.16 Å 3
Surface Area 380.91 Å 2
HOMO Energy -8.43 ± 0.55 eV
LUMO Energy -1.27 ± eV
Point Group Symmetry C1
Synonyms
  • 1-piperazinecarbothioamide, 4-methyl-n-(4-((4-nitrophenyl)amino)phenyl)-
  • 4-methyl-4'-(p-nitroanilino)thio-1-piperazinecarboxanilide
  • 4-methyl-n-(4-((4-nitrophenyl)amino)phenyl)-1-piperazinecarbothioamide
  • 4-methyl-n-[4-[(4-nitrophenyl)amino]phenyl]piperazine-1-carbothioamide
  • 4-methyl-n-{4-[(4-nitrophenyl)amino]phenyl}piperazine-1-carbothioamide
  • 4-nitro-4'-(n-methyl)piperazinyl thiocarbonylidodiphenylamine
  • amocarzine
  • cgp 6140
  • cgp-6140
  • phenthiourezine
  • s 80016
CAS Number(s)
  • 36590-19-9
  • 99402-78-5
InChIKey UFLRJROFPAGRPN-UHFFFAOYSA-N
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