Vitas-M small molecule compound
6-[(Z)-2-(5-chloro-2-ethoxyphenyl)ethenyl]-5-nitropyrimidine-2,4(1H,3H)-dione
Catalog ID
STK287083
SMILES CCOc1ccc(cc1/C=C\c1[nH]c(=O)[nH]c(=O)c1[N+](=O)[O-])Cl
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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 C14H12ClN3O5 MW 337.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H12ClN3O5/c1-2-23-11-6-4-9(15)7-8(11)3-5-10-12(18(21)22)13(19)17-14(20)16-10/h3-7H,2H2,1H3,(H2,16,17,19,20)/b5-3-InChIKey
XMZDODXUPBDYLM-HYXAFXHYSA-NSynonyms
6((Z)2(5CHLORO2ETHOXYPHENYL)ETHENYL)5NITRO1HPYRIMIDINE24DIONE
6((Z)2(5chloro2ethoxyphenyl)ethenyl)5nitropyrimidine24(1H3H)dione
CCOC1=C(C=C(C=C1)Cl)C=CC2=C(C(=O)NC(=O)N2)(N+)(=O)(O)
CCOc1ccc(cc1C=Cc1(nH)c(=O)(nH)c(=O)c1(N+)(=O)(O))Cl
InChI=1SC14H12ClN3O5c122311649(15)78(11)351012(18(21)22)13(19)1714(20)1610h37H2H21H3(H216171920)b53
MFCD04394694
ZINC000030840509
ZINC30840509
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