Vitas-M small molecule compound
(5E)-1-(4-bromophenyl)-5-{4-[(3,4-dichlorobenzyl)oxy]-3-methoxybenzylidene}pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STK022000
SMILES COc1cc(ccc1OCc1ccc(c(c1)Cl)Cl)/C=C/1\C(=O)NC(=O)N(C1=O)c1ccc(cc1)Br
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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 C25H17BrCl2N2O5 MW 576.23 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H17BrCl2N2O5/c1-34-22-12-14(3-9-21(22)35-13-15-2-8-19(27)20(28)11-15)10-18-23(31)29-25(33)30(24(18)32)17-6-4-16(26)5-7-17/h2-12H,13H2,1H3,(H,29,31,33)/b18-10+InChIKey
OWJMATCRYDUSQA-VCHYOVAHSA-NSynonyms
(5E)1(4BROMOPHENYL)5((4((34DICHLOROPHENYL)METHOXY)3METHOXYPHENYL)METHYLIDENE)13DIAZINANE246TRIONE
(5E)1(4BROMOPHENYL)5(4((34DICHLOROBENZYL)OXY)3METHOXYBENZYLIDENE)PYRIMIDINE246(1H3H5H)TRIONE
COC1=C(C=CC(=C1)C=C2C(=O)NC(=O)N(C2=O)C3=CC=C(C=C3)Br)OCC4=CC(=C(C=C4)Cl)Cl
COc1cc(ccc1OCc1ccc(c(c1)Cl)Cl)C=C1C(=O)NC(=O)N(C1=O)c1ccc(cc1)Br
InChI=1SC25H17BrCl2N2O5c134221214(3921(22)3513152819(27)20(28)1115)101823(31)2925(33)30(24(18)32)176416(26)5717h212H13H21H3(H293133)b1810+
MFCD02781502
STK022000
ZINC000097958042
ZINC97958042
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