Vitas-M small molecule compound
6-[(Z)-2-(3-bromo-4-hydroxyphenyl)ethenyl]-5-nitropyrimidine-2,4(1H,3H)-dione
Catalog ID
STK287021
SMILES O=c1[nH]c(/C=C\c2ccc(c(c2)Br)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 C12H8BrN3O5 MW 354.12 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H8BrN3O5/c13-7-5-6(2-4-9(7)17)1-3-8-10(16(20)21)11(18)15-12(19)14-8/h1-5,17H,(H2,14,15,18,19)/b3-1-InChIKey
UCKWOQZFDRKOMP-IWQZZHSRSA-NSynonyms
6((Z)2(3BROMO4HYDROXYPHENYL)ETHENYL)5NITRO1HPYRIMIDINE24DIONE
6((Z)2(3BROMO4HYDROXYPHENYL)ETHENYL)5NITROPYRIMIDINE24(1H3H)DIONE
C1=CC(=C(C=C1C=CC2=C(C(=O)NC(=O)N2)(N+)(=O)(O))Br)O
InChI=1SC12H8BrN3O5c13756(249(7)17)13810(16(20)21)11(18)1512(19)148h1517H(H214151819)b31
MFCD04398808
O=c1(nH)c(C=Cc2ccc(c(c2)Br)O)c(c(=O)(nH)1)(N+)(=O)(O)
ZINC000030840436
ZINC30840436
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