Vitas-M small molecule compound
(5E)-5-{5-bromo-2-[2-(3-ethyl-5-methylphenoxy)ethoxy]benzylidene}-1-(4-methoxyphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STK077400
SMILES COc1ccc(cc1)N1C(=O)NC(=O)/C(=C\c2cc(Br)ccc2OCCOc2cc(C)cc(c2)CC)/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 C29H27BrN2O6 MW 579.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H27BrN2O6/c1-4-19-13-18(2)14-24(15-19)37-11-12-38-26-10-5-21(30)16-20(26)17-25-27(33)31-29(35)32(28(25)34)22-6-8-23(36-3)9-7-22/h5-10,13-17H,4,11-12H2,1-3H3,(H,31,33,35)/b25-17+InChIKey
ARVUZNSZNGDGIU-KOEQRZSOSA-NSynonyms
(5E)5((5BROMO2(2(3ETHYL5METHYLPHENOXY)ETHOXY)PHENYL)METHYLIDENE)1(4METHOXYPHENYL)13DIAZINANE246TRIONE
(5E)5(5BROMO2(2(3ETHYL5METHYLPHENOXY)ETHOXY)BENZYLIDENE)1(4METHOXYPHENYL)PYRIMIDINE246(1H3H5H)TRIONE
CCC1=CC(=CC(=C1)C)OCCOC2=C(C=C(C=C2)Br)C=C3C(=O)NC(=O)N(C3=O)C4=CC=C(C=C4)OC
COc1ccc(cc1)N1C(=O)NC(=O)C(=Cc2cc(Br)ccc2OCCOc2cc(C)cc(c2)CC)C1=O
InChI=1SC29H27BrN2O6c14191318(2)1424(1519)371112382610521(30)1620(26)172527(33)3129(35)32(28(25)34)226823(363)9722h5101317H41112H213H3(H313335)b2517+
MFCD02017760
STK077400
ZINC000100159467
ZINC100159467
Check stock
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Check stock on Vitas-MAvailable files
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