Vitas-M small molecule compound

(5Z)-1-(4-bromophenyl)-5-{3-chloro-4-[(2-chlorobenzyl)oxy]-5-methoxybenzylidene}pyrimidine-2,4,6(1H,3H,5H)-trione

Catalog ID
STK022782
SMILES COc1cc(/C=C\2/C(=O)NC(=O)N(C2=O)c2ccc(cc2)Br)cc(c1OCc1ccccc1Cl)Cl

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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/c1-34-21-12-14(11-20(28)22(21)35-13-15-4-2-3-5-19(15)27)10-18-23(31)29-25(33)30(24(18)32)17-8-6-16(26)7-9-17/h2-12H,13H2,1H3,(H,29,31,33)/b18-10-
InChIKey
ABPGVZBWXLEWAP-ZDLGFXPLSA-N
Synonyms

(5Z)1(4bromophenyl)5((3chloro4((2chlorophenyl)methoxy)5methoxyphenyl)methylidene)13diazinane246trione
(5Z)1(4BROMOPHENYL)5(3CHLORO4((2CHLOROBENZYL)OXY)5METHOXYBENZYLIDENE)PYRIMIDINE246(1H3H5H)TRIONE
COC1=C(C(=CC(=C1)C=C2C(=O)NC(=O)N(C2=O)C3=CC=C(C=C3)Br)Cl)OCC4=CC=CC=C4Cl
COc1cc(C=C2C(=O)NC(=O)N(C2=O)c2ccc(cc2)Br)cc(c1OCc1ccccc1Cl)Cl
InChI=1SC25H17BrCl2N2O5c134211214(1120(28)22(21)351315423519(15)27)101823(31)2925(33)30(24(18)32)178616(26)7917h212H13H21H3(H293133)b1810
MFCD05976193
STK022782
ZINC000097958052
ZINC97958052

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Available files

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