Vitas-M small molecule compound
2-[(E)-2-(4-ethylphenyl)ethenyl]-6-hydroxy-5-nitropyrimidin-4(3H)-one
Catalog ID
STK743690
SMILES CCc1ccc(cc1)/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 C14H13N3O4 MW 287.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H13N3O4/c1-2-9-3-5-10(6-4-9)7-8-11-15-13(18)12(17(20)21)14(19)16-11/h3-8H,2H2,1H3,(H2,15,16,18,19)/b8-7+InChIKey
YOAOZONJAKGASE-BQYQJAHWSA-NSynonyms
708975-41-1(E)2(4ethylstyryl)6hydroxy5nitropyrimidin4(3H)one
2((1E)2(4ETHYLPHENYL)VINYL)5NITROPYRIMIDINE46DIOL
2((E)2(4ETHYLPHENYL)ETHENYL)4HYDROXY5NITRO1HPYRIMIDIN6ONE
2((E)2(4ethylphenyl)ethenyl)6hydroxy5nitropyrimidin4(3H)one
708975411
CCC1=CC=C(C=C1)C=CC2=NC(=C(C(=O)N2)(N+)(=O)(O))O
CCc1ccc(cc1)C=Cc1nc(O)c(c(=O)(nH)1)(N+)(=O)(O)
InChI=1SC14H13N3O4c1293510(649)78111513(18)12(17(20)21)14(19)1611h38H2H21H3(H215161819)b87+
MFCD06150490
ZINC000009234766
ZINC9234766
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