N-(Isopropylcarbamoyl)-2-[(3-Methylphenyl)Amino]-5-Nitrobenzenesulfonamide

Molecule SVG Image

Properties Simple | Detailed

Formula C17H20N4O5S
IUPAC Name 1-isopropyl-3-[2-(3-methylanilino)-5-nitro-phenyl]sulfonyl-urea
Molecular Mass 392.430 g·mol−1
Heat of Formation -479.0 ± 16.7 kJ·mol−1
Dipole Moment 10.10 ± 1.08 D
Volume 435.77 Å 3
Surface Area 382.79 Å 2
HOMO Energy -9.06 ± 0.55 eV
LUMO Energy -1.07 ± eV
Point Group Symmetry C1
Synonyms
  • 1-[2-[(3-methylphenyl)amino]-5-nitro-phenyl]sulfonyl-3-propan-2-yl-urea
  • 1-[2-[(3-methylphenyl)amino]-5-nitrophenyl]sulfonyl-3-propan-2-ylurea
  • 3-isopropyl-1-[2-[(3-methylphenyl)amino]-5-nitro-phenyl]sulfonyl-urea
  • 3-isopropyl-1-[2-[(3-methylphenyl)amino]-5-nitrophenyl]sulfonylurea
  • bm-500
InChIKey SXERSHFSQXOIPF-UHFFFAOYSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H S C O N