N-{4-[(6-Methyl-4-Oxo-1,4-Dihydro-2-Pyrimidinyl)Sulfamoyl]Phenyl}Acetamide

Molecule SVG Image

Properties Simple | Detailed

Formula C13H15N4O4S+
IUPAC Name n-[4-[(6-methyl-4-oxo-5h-pyrimidin-1-ium-5-id-2-yl)sulfamoyl]phenyl]acetamide
Molecular Mass 323.348 g·mol−1
Heat of Formation -508.2 ± 16.7 kJ·mol−1
Dipole Moment 9.30 ± 1.08 D
Volume 349.68 Å 3
Surface Area 318.08 Å 2
HOMO Energy -9.31 ± 0.55 eV
LUMO Energy -0.52 ± eV
Point Group Symmetry C1
Synonyms
  • acetamide, n-(4-(((1,4-dihydro-6-methyl-4-oxo-2-pyrimidinyl)amino)sulfonyl)phenyl)-, (2s-(2r*,5r*))-
  • n-4-acetyl-4-hydroxysulfamerazine
  • n-4-ahsa
  • n-[4-[(4-keto-6-methyl-1h-pyrimidin-2-yl)sulfamoyl]phenyl]acetamide
  • n-[4-[(4-methyl-6-oxo-3h-pyrimidin-2-yl)sulfamoyl]phenyl]acetamide
  • n-[4-[(4-methyl-6-oxo-3h-pyrimidin-2-yl)sulfamoyl]phenyl]ethanamide
CAS Number(s)
  • 90831-56-4
InChIKey KGNVJSUKFQQWNI-UHFFFAOYSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H S C O N