Vitas-M small molecule compound
(5E)-1-(4-bromophenyl)-5-{3-ethoxy-4-[(2-methylbenzyl)oxy]benzylidene}pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STK045866
SMILES CCOc1cc(ccc1OCc1ccccc1C)/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 C27H23BrN2O5 MW 535.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H23BrN2O5/c1-3-34-24-15-18(8-13-23(24)35-16-19-7-5-4-6-17(19)2)14-22-25(31)29-27(33)30(26(22)32)21-11-9-20(28)10-12-21/h4-15H,3,16H2,1-2H3,(H,29,31,33)/b22-14+InChIKey
VWMXZIZKJQHGFV-HYARGMPZSA-NSynonyms
(5E)1(4BROMOPHENYL)5((3ETHOXY4((2METHYLPHENYL)METHOXY)PHENYL)METHYLIDENE)13DIAZINANE246TRIONE
(5E)1(4BROMOPHENYL)5(3ETHOXY4((2METHYLBENZYL)OXY)BENZYLIDENE)PYRIMIDINE246(1H3H5H)TRIONE
CCOC1=C(C=CC(=C1)C=C2C(=O)NC(=O)N(C2=O)C3=CC=C(C=C3)Br)OCC4=CC=CC=C4C
CCOc1cc(ccc1OCc1ccccc1C)C=C1C(=O)NC(=O)N(C1=O)c1ccc(cc1)Br
InChI=1SC27H23BrN2O5c1334241518(81323(24)351619754617(19)2)142225(31)2927(33)30(26(22)32)2111920(28)101221h415H316H212H3(H293133)b2214+
MFCD08050876
STK045866
ZINC000097958613
ZINC97958613
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