Vitas-M small molecule compound
(5E)-1-(4-bromophenyl)-5-{4-[2-(2,4-dimethylphenoxy)ethoxy]benzylidene}pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STK042186
SMILES Brc1ccc(cc1)N1C(=O)NC(=O)/C(=C\c2ccc(cc2)OCCOc2ccc(cc2C)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 C27H23BrN2O5 MW 535.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H23BrN2O5/c1-17-3-12-24(18(2)15-17)35-14-13-34-22-10-4-19(5-11-22)16-23-25(31)29-27(33)30(26(23)32)21-8-6-20(28)7-9-21/h3-12,15-16H,13-14H2,1-2H3,(H,29,31,33)/b23-16+InChIKey
UTJROQDINCCBAN-XQNSMLJCSA-NSynonyms
(5E)1(4BROMOPHENYL)5((4(2(24DIMETHYLPHENOXY)ETHOXY)PHENYL)METHYLIDENE)13DIAZINANE246TRIONE
(5E)1(4BROMOPHENYL)5(4(2(24DIMETHYLPHENOXY)ETHOXY)BENZYLIDENE)PYRIMIDINE246(1H3H5H)TRIONE
Brc1ccc(cc1)N1C(=O)NC(=O)C(=Cc2ccc(cc2)OCCOc2ccc(cc2C)C)C1=O
CC1=CC(=C(C=C1)OCCOC2=CC=C(C=C2)C=C3C(=O)NC(=O)N(C3=O)C4=CC=C(C=C4)Br)C
InChI=1SC27H23BrN2O5c11731224(18(2)1517)351413342210419(51122)162325(31)2927(33)30(26(23)32)218620(28)7921h3121516H1314H212H3(H293133)b2316+
MFCD08050727
STK042186
ZINC000097958558
ZINC97958558
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