Vitas-M small molecule compound

3-butyl-5-fluoro-1-(4-methoxy-3-nitrobenzyl)pyrimidine-2,4(1H,3H)-dione

Catalog ID
STK333615
SMILES CCCCn1c(=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 C16H18FN3O5 MW 351.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18FN3O5/c1-3-4-7-19-15(21)12(17)10-18(16(19)22)9-11-5-6-14(25-2)13(8-11)20(23)24/h5-6,8,10H,3-4,7,9H2,1-2H3
InChIKey
BFBOGOOLMPHJJH-UHFFFAOYSA-N
Synonyms
674329-07-8
3BUTYL5FLUORO1((4METHOXY3NITROPHENYL)METHYL)PYRIMIDINE24DIONE
3BUTYL5FLUORO1(4METHOXY3NITROBENZYL)1HPYRIMIDINE24DIONE
3butyl5fluoro1(4methoxy3nitrobenzyl)pyrimidine24(1H3H)dione
674329078
CCCCN1C(=O)C(=CN(C1=O)CC2=CC(=C(C=C2)OC)(N+)(=O)(O))F
CCCCn1c(=O)n(Cc2ccc(c(c2)(N+)(=O)(O))OC)cc(c1=O)F
InChI=1SC16H18FN3O5c13471915(21)12(17)1018(16(19)22)9115614(252)13(811)20(23)24h56810H3479H212H3
MFCD03867394
ZINC000001864858
ZINC01864858
ZINC1864858

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Available files

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