Vitas-M small molecule compound

2-[(E)-2-{3-bromo-4-[(2-chlorobenzyl)oxy]phenyl}ethenyl]-5-nitropyrimidine-4,6-diol

Catalog ID
STK612928
SMILES Brc1cc(ccc1OCc1ccccc1Cl)/C=C/c1nc(O)c(c(n1)O)[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 C19H13BrClN3O5 MW 478.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H13BrClN3O5/c20-13-9-11(5-7-15(13)29-10-12-3-1-2-4-14(12)21)6-8-16-22-18(25)17(24(27)28)19(26)23-16/h1-9H,10H2,(H2,22,23,25,26)/b8-6+
InChIKey
VACKMYIHWDTYBD-SOFGYWHQSA-N
Synonyms
708289-16-1
2((E)2(3bromo4((2chlorobenzyl)oxy)phenyl)ethenyl)5nitropyrimidine46diol
2((E)2(3BROMO4((2CHLOROPHENYL)METHOXY)PHENYL)ETHENYL)4HYDROXY5NITRO1HPYRIMIDIN6ONE
708289161
Brc1cc(ccc1OCc1ccccc1Cl)C=Cc1nc(O)c(c(n1)O)(N+)(=O)(O)
C1=CC=C(C(=C1)COC2=C(C=C(C=C2)C=CC3=NC(=C(C(=O)N3)(N+)(=O)(O))O)Br)Cl
InChI=1SC19H13BrClN3O5c2013911(5715(13)291012312414(12)21)68162218(25)17(24(27)28)19(26)2316h19H10H2(H222232526)b86+
MFCD08736464
ZINC000017112606
ZINC17112606

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Available files

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