L2K

3-[3,4-bis(fluoranyl)phenyl]-1,4,6,7-tetrahydroimidazo[2,1-c][1,2,4]triazine

Created: 2019-07-16
Last modified:  2020-04-15

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Chemical Details

Formal Charge0
Atom Count27
Chiral Atom Count0
Bond Count29
Aromatic Bond Count6
2D diagram of L2K

Chemical Component Summary

Name3-[3,4-bis(fluoranyl)phenyl]-1,4,6,7-tetrahydroimidazo[2,1-c][1,2,4]triazine
Systematic Name (OpenEye OEToolkits)3-[3,4-bis(fluoranyl)phenyl]-1,4,6,7-tetrahydroimidazo[2,1-c][1,2,4]triazine
FormulaC11 H10 F2 N4
Molecular Weight236.221
TypeNON-POLYMER

Chemical Descriptors

TypeProgram Version Descriptor
SMILESCACTVS3.385Fc1ccc(cc1F)C2=NNC3=NCCN3C2
SMILESOpenEye OEToolkits2.0.7c1cc(c(cc1C2=NNC3=NCCN3C2)F)F
Canonical SMILESCACTVS3.385 Fc1ccc(cc1F)C2=NNC3=NCCN3C2
Canonical SMILESOpenEye OEToolkits2.0.7 c1cc(c(cc1C2=NNC3=NCCN3C2)F)F
InChIInChI1.03 InChI=1S/C11H10F2N4/c12-8-2-1-7(5-9(8)13)10-6-17-4-3-14-11(17)16-15-10/h1-2,5H,3-4,6H2,(H,14,16)
InChIKeyInChI1.03 HQCSFWFWWSDEFP-UHFFFAOYSA-N

Related Resource References

Resource NameReference
PubChem 2800035