Vitas-M small molecule compound
(5Z)-5-(3-bromo-5-methoxy-4-{2-[2-(prop-2-en-1-yl)phenoxy]ethoxy}benzylidene)-1-(4-methoxyphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STK067199
SMILES C=CCc1ccccc1OCCOc1c(Br)cc(cc1OC)/C=C\1/C(=O)NC(=O)N(C1=O)c1ccc(cc1)OC
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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 C30H27BrN2O7 MW 607.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H27BrN2O7/c1-4-7-20-8-5-6-9-25(20)39-14-15-40-27-24(31)17-19(18-26(27)38-3)16-23-28(34)32-30(36)33(29(23)35)21-10-12-22(37-2)13-11-21/h4-6,8-13,16-18H,1,7,14-15H2,2-3H3,(H,32,34,36)/b23-16-InChIKey
HLIFJTJBTGVJDA-KQWNVCNZSA-NSynonyms
(5Z)5((3BROMO5METHOXY4(2(2PROP2ENYLPHENOXY)ETHOXY)PHENYL)METHYLIDENE)1(4METHOXYPHENYL)13DIAZINANE246TRIONE
(5Z)5(3BROMO5METHOXY4(2(2(PROP2EN1YL)PHENOXY)ETHOXY)BENZYLIDENE)1(4METHOXYPHENYL)PYRIMIDINE246(1H3H5H)TRIONE
C=CCc1ccccc1OCCOc1c(Br)cc(cc1OC)C=C1C(=O)NC(=O)N(C1=O)c1ccc(cc1)OC
COC1=CC=C(C=C1)N2C(=O)C(=CC3=CC(=C(C(=C3)Br)OCCOC4=CC=CC=C4CC=C)OC)C(=O)NC2=O
InChI=1SC30H27BrN2O7c14720856925(20)391415402724(31)1719(1826(27)383)162328(34)3230(36)33(29(23)35)21101222(372)131121h468131618H171415H223H3(H323436)b2316
MFCD02017692
STK067199
ZINC000100270777
ZINC100270777
Check stock
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Check stock on Vitas-MAvailable files
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