Vitas-M small molecule compound
(5E)-1-(4-tert-butylphenyl)-5-{4-[(4-fluorobenzyl)oxy]-3-methoxybenzylidene}pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STL374946
SMILES COc1cc(ccc1OCc1ccc(cc1)F)/C=C/1\C(=O)NC(=O)N(C1=O)c1ccc(cc1)C(C)(C)C
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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 C29H27FN2O5 MW 502.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H27FN2O5/c1-29(2,3)20-8-12-22(13-9-20)32-27(34)23(26(33)31-28(32)35)15-19-7-14-24(25(16-19)36-4)37-17-18-5-10-21(30)11-6-18/h5-16H,17H2,1-4H3,(H,31,33,35)/b23-15+InChIKey
WWKCSBOUBBLXQQ-HZHRSRAPSA-NSynonyms
(5E)1(4TERTBUTYLPHENYL)5((4((4FLUOROPHENYL)METHOXY)3METHOXYPHENYL)METHYLIDENE)13DIAZINANE246TRIONE
(5E)1(4tertbutylphenyl)5(4((4fluorobenzyl)oxy)3methoxybenzylidene)pyrimidine246(1H3H5H)trione
CC(C)(C)C1=CC=C(C=C1)N2C(=O)C(=CC3=CC(=C(C=C3)OCC4=CC=C(C=C4)F)OC)C(=O)NC2=O
COc1cc(ccc1OCc1ccc(cc1)F)C=C1C(=O)NC(=O)N(C1=O)c1ccc(cc1)C(C)(C)C
InChI=1SC29H27FN2O5c129(23)2081222(13920)3227(34)23(26(33)3128(32)35)151971424(25(1619)364)37171851021(30)11618h516H17H214H3(H313335)b2315+
MFCD02047064
ZINC000006075447
ZINC06075447
ZINC6075447
Check stock
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