Vitas-M small molecule compound
(5E)-5-{4-[(4-chlorobenzyl)oxy]-3-methoxybenzylidene}-1-(4-methoxyphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STL418830
SMILES COc1ccc(cc1)N1C(=O)NC(=O)/C(=C\c2ccc(c(c2)OC)OCc2ccc(cc2)Cl)/C1=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 C26H21ClN2O6 MW 492.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H21ClN2O6/c1-33-20-10-8-19(9-11-20)29-25(31)21(24(30)28-26(29)32)13-17-5-12-22(23(14-17)34-2)35-15-16-3-6-18(27)7-4-16/h3-14H,15H2,1-2H3,(H,28,30,32)/b21-13+InChIKey
YHOHRPOKXMLUMT-FYJGNVAPSA-NSynonyms
(5E)5((4((4CHLOROPHENYL)METHOXY)3METHOXYPHENYL)METHYLIDENE)1(4METHOXYPHENYL)13DIAZINANE246TRIONE
(5E)5(4((4chlorobenzyl)oxy)3methoxybenzylidene)1(4methoxyphenyl)pyrimidine246(1H3H5H)trione
COC1=CC=C(C=C1)N2C(=O)C(=CC3=CC(=C(C=C3)OCC4=CC=C(C=C4)Cl)OC)C(=O)NC2=O
COc1ccc(cc1)N1C(=O)NC(=O)C(=Cc2ccc(c(c2)OC)OCc2ccc(cc2)Cl)C1=O
InChI=1SC26H21ClN2O6c1332010819(91120)2925(31)21(24(30)2826(29)32)131751222(23(1417)342)3515163618(27)7416h314H15H212H3(H283032)b2113+
MFCD04083346
ZINC000009310351
ZINC09310351
ZINC9310351
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