Vitas-M small molecule compound
2-[(Z)-2-{3-bromo-4-[(2-chlorobenzyl)oxy]phenyl}ethenyl]-6-hydroxy-5-nitropyrimidin-4(3H)-one
Catalog ID
STL023982
SMILES Brc1cc(ccc1OCc1ccccc1Cl)/C=C\c1nc(O)c(c(=O)[nH]1)[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-VURMDHGXSA-NSynonyms
(E)2(3bromo4((2chlorobenzyl)oxy)styryl)6hydroxy5nitropyrimidin4(3H)one
2((Z)2(3bromo4((2chlorobenzyl)oxy)phenyl)ethenyl)6hydroxy5nitropyrimidin4(3H)one
2((Z)2(3BROMO4((2CHLOROPHENYL)METHOXY)PHENYL)ETHENYL)4HYDROXY5NITRO1HPYRIMIDIN6ONE
Brc1cc(ccc1OCc1ccccc1Cl)C=Cc1nc(O)c(c(=O)(nH)1)(N+)(=O)(O)
InChI=1SC19H13BrClN3O5c2013911(5715(13)291012312414(12)21)68162218(25)17(24(27)28)19(26)2316h19H10H2(H222232526)b86
MFCD05993032
ZINC000016361767
ZINC16361767
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