Vitas-M small molecule compound

5-fluoro-1-(4-methoxy-3-nitrobenzyl)-3-(prop-2-en-1-yl)pyrimidine-2,4(1H,3H)-dione

Catalog ID
STL443578
SMILES C=CCn1c(=O)n(Cc2ccc(c(c2)[N+](=O)[O-])OC)cc(c1=O)F

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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 C15H14FN3O5 MW 335.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H14FN3O5/c1-3-6-18-14(20)11(16)9-17(15(18)21)8-10-4-5-13(24-2)12(7-10)19(22)23/h3-5,7,9H,1,6,8H2,2H3
InChIKey
FAGZNMWOFMIKQO-UHFFFAOYSA-N
Synonyms

3ALLYL5FLUORO1(4METHOXY3NITROBENZYL)PYRIMIDINE24(1H3H)DIONE
5FLUORO1((4METHOXY3NITROPHENYL)METHYL)3PROP2ENYLPYRIMIDINE24DIONE
5fluoro1(4methoxy3nitrobenzyl)3(prop2en1yl)pyrimidine24(1H3H)dione
C=CCn1c(=O)n(Cc2ccc(c(c2)(N+)(=O)(O))OC)cc(c1=O)F
COC1=C(C=C(C=C1)CN2C=C(C(=O)N(C2=O)CC=C)F)(N+)(=O)(O)
InChI=1SC15H14FN3O5c1361814(20)11(16)917(15(18)21)8104513(242)12(710)19(22)23h3579H168H22H3
MFCD00391257
ZINC000001407605
ZINC1407605

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Available files

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