Vitas-M small molecule compound

N~4~-(2-fluorophenyl)-5-nitro-N~2~-(prop-2-en-1-yl)pyrimidine-2,4,6-triamine

Catalog ID
STK844735
SMILES C=CCNc1nc(Nc2ccccc2F)c(c(n1)N)[N+](=O)[O-]

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C13H13FN6O2 MW 304.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H13FN6O2/c1-2-7-16-13-18-11(15)10(20(21)22)12(19-13)17-9-6-4-3-5-8(9)14/h2-6H,1,7H2,(H4,15,16,17,18,19)
InChIKey
MXMDNCJPFHYCFX-UHFFFAOYSA-N
Synonyms
835910-25-3
(6AMINO5NITRO2(PROP2ENYLAMINO)PYRIMIDIN4YL)(2FLUOROPHENYL)AMINE
4N(2FLUOROPHENYL)5NITRO2NPROP2ENYLPYRIMIDINE246TRIAMINE
835910253
C=CCNC1=NC(=C(C(=N1)NC2=CC=CC=C2F)(N+)(=O)(O))N
C=CCNc1nc(Nc2ccccc2F)c(c(n1)N)(N+)(=O)(O)
InChI=1SC13H13FN6O2c12716131811(15)10(20(21)22)12(1913)17964358(9)14h26H17H2(H41516171819)
MFCD03687158
N~4~(2fluorophenyl)5nitroN~2~(prop2en1yl)pyrimidine246triamine
N2allylN4(2fluorophenyl)5nitropyrimidine246triamine
N4(2FLUOROPHENYL)5NITRON2(PROP2EN1YL)PYRIMIDINE246TRIAMINE
ZINC000004305912
ZINC04305912
ZINC4305912

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Available files

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