CHEBI:108468 - N2-(3-fluorophenyl)-N4-(2-furanylmethyl)-5-nitropyrimidine-2,4,6-triamine

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name N2-(3-fluorophenyl)-N4-(2-furanylmethyl)-5-nitropyrimidine-2,4,6-triamine
ChEBI ID CHEBI:108468
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C15H13FN6O3
Net Charge 0
Average Mass 344.301
Monoisotopic Mass 344.10332
InChI InChI=1S/C15H13FN6O3/c16-9-3-1-4-10(7-9)19-15-20-13(17)12(22(23)24)14(21-15)18-8-11-5-2-6-25-11/h1-7H,8H2,(H4,17,18,19,20,21)
InChIKey ASPPPXMWIWFZPH-UHFFFAOYSA-N
SMILES C1=CC(=CC(=C1)F)NC2=NC(=C(C(=N2)NCC3=CC=CO3)[N+](=O)[O-])N
ChEBI Ontology
Outgoing N2-(3-fluorophenyl)-N4-(2-furanylmethyl)-5-nitropyrimidine-2,4,6-triamine (CHEBI:108468) is a C-nitro compound (CHEBI:35716)
Manual Xref Database
LSM-19844 LINCS
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