Vitas-M small molecule compound
5-{3-ethoxy-4-[2-(4-nitrophenoxy)ethoxy]benzylidene}pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STK074182
SMILES CCOc1cc(ccc1OCCOc1ccc(cc1)[N+](=O)[O-])C=C1C(=O)NC(=O)NC1=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 C21H19N3O8 MW 441.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19N3O8/c1-2-30-18-12-13(11-16-19(25)22-21(27)23-20(16)26)3-8-17(18)32-10-9-31-15-6-4-14(5-7-15)24(28)29/h3-8,11-12H,2,9-10H2,1H3,(H2,22,23,25,26,27)InChIKey
FBUKBDXIYGHBHZ-UHFFFAOYSA-NSynonyms
5((3ETHOXY4(2(4NITROPHENOXY)ETHOXY)PHENYL)METHYLIDENE)13DIAZINANE246TRIONE
5(3ETHOXY4(2(4NITROPHENOXY)ETHOXY)BENZYLIDENE)PYRIMIDINE246(1H3H5H)TRIONE
CCOC1=C(C=CC(=C1)C=C2C(=O)NC(=O)NC2=O)OCCOC3=CC=C(C=C3)(N+)(=O)(O)
CCOc1cc(ccc1OCCOc1ccc(cc1)(N+)(=O)(O))C=C1C(=O)NC(=O)NC1=O
InChI=1SC21H19N3O8c1230181213(111619(25)2221(27)2320(16)26)3817(18)3210931156414(5715)24(28)29h381112H2910H21H3(H22223252627)
MFCD01873418
STK074182
ZINC000002997168
ZINC2997168
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