N-(1-Methyl-5-Indolyl)-N'-(3-Methyl-5-Isothiazolyl)Urea

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Properties Simple | Detailed

Formula C14H14N4OS
IUPAC Name 1-(1-methylindol-1-ium-5-yl)-3-(3-methylisothiazol-5-yl)urea
Molecular Mass 286.352 g·mol−1
Heat of Formation 150.6 ± 16.7 kJ·mol−1
Dipole Moment 7.55 ± 1.08 D
Volume 326.16 Å 3
Surface Area 309.38 Å 2
HOMO Energy -8.26 ± 0.55 eV
LUMO Energy -0.55 ± eV
Point Group Symmetry Cs
Synonyms
  • 1-(1-methyl-5-indolyl)-3-(3-methyl-5-isothiazolyl)urea
  • 1-(1-methylindol-5-yl)-3-(3-methyl-1,2-thiazol-5-yl)urea
  • 1-(1-methylindol-5-yl)-3-(3-methylisothiazol-5-yl)urea
  • n-(1-methyl-1h-5-indolyl)-n'-(3-methyl-5-isothiazolyl)urea
  • pdsp1_001580
  • pdsp2_001564
  • sb 204741
  • sb204741
  • tocris-1372
InChIKey USFUFHFQWXDVMH-UHFFFAOYSA-N
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