Vitas-M small molecule compound
(5E)-5-({1-[2-(2-chlorophenoxy)ethyl]-1H-pyrrol-2-yl}methylidene)-3-(4-ethylphenyl)-6-hydroxypyrimidine-2,4(3H,5H)-dione
Catalog ID
STK559258
SMILES CCc1ccc(cc1)N1C(=O)N=C(/C(=C\c2cccn2CCOc2ccccc2Cl)/C1=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 C25H22ClN3O4 MW 463.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22ClN3O4/c1-2-17-9-11-18(12-10-17)29-24(31)20(23(30)27-25(29)32)16-19-6-5-13-28(19)14-15-33-22-8-4-3-7-21(22)26/h3-13,16H,2,14-15H2,1H3,(H,27,30,32)/b20-16+InChIKey
BFJLJVUERGPYRO-CAPFRKAQSA-NSynonyms
578759-87-2(5E)5((1(2(2chlorophenoxy)ethyl)1Hpyrrol2yl)methylidene)3(4ethylphenyl)6hydroxypyrimidine24(3H5H)dione
(5E)5((1(2(2CHLOROPHENOXY)ETHYL)PYRROL2YL)METHYLIDENE)1(4ETHYLPHENYL)13DIAZINANE246TRIONE
578759872
CCC1=CC=C(C=C1)N2C(=O)C(=CC3=CC=CN3CCOC4=CC=CC=C4Cl)C(=O)NC2=O
CCc1ccc(cc1)N1C(=O)N=C(C(=Cc2cccn2CCOc2ccccc2Cl)C1=O)O
InChI=1SC25H22ClN3O4c121791118(121017)2924(31)20(23(30)2725(29)32)1619651328(19)14153322843721(22)26h31316H21415H21H3(H273032)b2016+
MFCD04082392
ZINC000002372025
ZINC2372025
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