Vitas-M small molecule compound
(5Z)-1-(4-bromophenyl)-5-(3,5-dichloro-4-{2-[5-methyl-2-(propan-2-yl)phenoxy]ethoxy}benzylidene)pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STK034480
SMILES Brc1ccc(cc1)N1C(=O)NC(=O)/C(=C/c2cc(Cl)c(c(c2)Cl)OCCOc2cc(C)ccc2C(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 C29H25BrCl2N2O5 MW 632.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H25BrCl2N2O5/c1-16(2)21-9-4-17(3)12-25(21)38-10-11-39-26-23(31)14-18(15-24(26)32)13-22-27(35)33-29(37)34(28(22)36)20-7-5-19(30)6-8-20/h4-9,12-16H,10-11H2,1-3H3,(H,33,35,37)/b22-13-InChIKey
OLUFZXXEZDUIDD-XKZIYDEJSA-NSynonyms
(5Z)1(4bromophenyl)5((35dichloro4(2(5methyl2propan2ylphenoxy)ethoxy)phenyl)methylidene)13diazinane246trione
(5Z)1(4BROMOPHENYL)5(35DICHLORO4(2(5METHYL2(PROPAN2YL)PHENOXY)ETHOXY)BENZYLIDENE)PYRIMIDINE246(1H3H5H)TRIONE
Brc1ccc(cc1)N1C(=O)NC(=O)C(=Cc2cc(Cl)c(c(c2)Cl)OCCOc2cc(C)ccc2C(C)C)C1=O
CC1=CC(=C(C=C1)C(C)C)OCCOC2=C(C=C(C=C2Cl)C=C3C(=O)NC(=O)N(C3=O)C4=CC=C(C=C4)Br)Cl
InChI=1SC29H25BrCl2N2O5c116(2)219417(3)1225(21)381011392623(31)1418(1524(26)32)132227(35)3329(37)34(28(22)36)207519(30)6820h491216H1011H213H3(H333537)b2213
MFCD08050410
STK034480
ZINC000097958463
ZINC97958463
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