Substance Profile

8-Methyl-6-methylsulfanyl-3-nitro-9-oxo-8,9-dihydro-5-thia-8-aza-benzocycloheptene-7-carbonitrile

  • Molecular Formula: C12H9N3O3S2
  • Element System: C-H-N-O-S
  • CAS-RN:
  • InChI: InChI=1S/C12H9N3O3S2/c1-14-9(6-13)12(19-2)20-10-5-7(15(17)18)3-4-8(10)11(14)16/h3-5H,1-2H3
  • InChI Key: YWAAFCQAGLHXNR-UHFFFAOYSA-N

Chemical Properties + Synthesis

  • Molecular Weight: 307.3543
  • Calculated Log P: 2.731
  • Rotatable Bonds: 5
  • H Acceptors: 2
  • H Donators: 0
  • Reactions having this substance as a reactant:
  • Reactions having this substance as a product: 1
  • Journal articles containing this substance: 1
  • Patents containing this substance:
  • Other publications containing this substance:
  • Suppliers:

Data from SPRESIweb

3D Interactive Structure