Vitas-M small molecule compound

(5E)-1-(4-bromophenyl)-5-{4-[(3-methylbenzyl)oxy]benzylidene}pyrimidine-2,4,6(1H,3H,5H)-trione

Catalog ID
STK020632
SMILES Brc1ccc(cc1)N1C(=O)NC(=O)/C(=C\c2ccc(cc2)OCc2cccc(c2)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 C25H19BrN2O4 MW 491.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H19BrN2O4/c1-16-3-2-4-18(13-16)15-32-21-11-5-17(6-12-21)14-22-23(29)27-25(31)28(24(22)30)20-9-7-19(26)8-10-20/h2-14H,15H2,1H3,(H,27,29,31)/b22-14+
InChIKey
SPQPMTSMRWVQGR-HYARGMPZSA-N
Synonyms

(5E)1(4BROMOPHENYL)5((4((3METHYLPHENYL)METHOXY)PHENYL)METHYLIDENE)13DIAZINANE246TRIONE
(5E)1(4BROMOPHENYL)5(4((3METHYLBENZYL)OXY)BENZYLIDENE)PYRIMIDINE246(1H3H5H)TRIONE
Brc1ccc(cc1)N1C(=O)NC(=O)C(=Cc2ccc(cc2)OCc2cccc(c2)C)C1=O
CC1=CC(=CC=C1)COC2=CC=C(C=C2)C=C3C(=O)NC(=O)N(C3=O)C4=CC=C(C=C4)Br
InChI=1SC25H19BrN2O4c11632418(1316)15322111517(61221)142223(29)2725(31)28(24(22)30)209719(26)81020h214H15H21H3(H272931)b2214+
MFCD02781497
STK020632
ZINC000009057139
ZINC09057139
ZINC9057139

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Available files

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