3-Amino-6-Chloro-N-(Diaminomethylene)-5-[Isobutyl(Methyl)Amino]-2-Pyrazinecarboxamide

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Properties Simple | Detailed

Formula C11H18ClN7O
IUPAC Name 3-amino-6-chloro-n-(diaminomethylene)-5-[isobutyl(methyl)amino]pyrazine-2-carboxamide
Molecular Mass 299.760 g·mol−1
Heat of Formation -45.2 ± 16.7 kJ·mol−1
Dipole Moment 4.23 ± 1.08 D
Volume 349.9 Å 3
Surface Area 312.13 Å 2
HOMO Energy -8.63 ± 0.55 eV
LUMO Energy -0.70 ± eV
Point Group Symmetry C1
Synonyms
  • 3-amino-5-(n-methyl-n-isobutylamino)-n-(aminoiminomethyl)-6-chloropyrazinecarboxamide
  • 3-amino-6-chloro-n-(diaminomethylene)-5-(isobutyl-methyl-amino)pyrazinamide
  • 3-amino-6-chloro-n-(diaminomethylene)-5-(isobutyl-methyl-amino)pyrazine-2-carboxamide
  • 3-amino-6-chloro-n-(diaminomethylene)-5-(isobutyl-methylamino)-2-pyrazinecarboxamide
  • 5-(n-methyl-n-isobutyl)- amiloride
  • 5-(n-methyl-n-isobutyl)-amiloride
  • 5-(n-methyl-n-isobutyl)amiloride
  • 5-nmnia
  • methylisobutylamiloride
  • pyrazinecarboxamide, 3-amino-n-(aminoiminomethyl)-6-chloro-5-(methyl(2-methylpropyl)amino)-
CAS Number(s)
  • 96861-65-3
InChIKey RVIUMPLAOXSSGN-UHFFFAOYSA-N
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Elements H C N O Cl