Vitas-M small molecule compound
(5E)-5-{5-bromo-2-[2-(4-tert-butylphenoxy)ethoxy]benzylidene}-1-(4-methoxyphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STK074201
SMILES COc1ccc(cc1)N1C(=O)NC(=O)/C(=C\c2cc(Br)ccc2OCCOc2ccc(cc2)C(C)(C)C)/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 C30H29BrN2O6 MW 593.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H29BrN2O6/c1-30(2,3)20-5-10-24(11-6-20)38-15-16-39-26-14-7-21(31)17-19(26)18-25-27(34)32-29(36)33(28(25)35)22-8-12-23(37-4)13-9-22/h5-14,17-18H,15-16H2,1-4H3,(H,32,34,36)/b25-18+InChIKey
LOJXIFHJJFKDND-XIEYBQDHSA-NSynonyms
(5E)5((5BROMO2(2(4TERTBUTYLPHENOXY)ETHOXY)PHENYL)METHYLIDENE)1(4METHOXYPHENYL)13DIAZINANE246TRIONE
(5E)5(5BROMO2(2(4TERTBUTYLPHENOXY)ETHOXY)BENZYLIDENE)1(4METHOXYPHENYL)PYRIMIDINE246(1H3H5H)TRIONE
CC(C)(C)C1=CC=C(C=C1)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)ccc2OCCOc2ccc(cc2)C(C)(C)C)C1=O
InChI=1SC30H29BrN2O6c130(23)2051024(11620)381516392614721(31)1719(26)182527(34)3229(36)33(28(25)35)2281223(374)13922h5141718H1516H214H3(H323436)b2518+
MFCD02017759
STK074201
ZINC000100344998
ZINC100344998
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