Vitas-M small molecule compound
(5E)-5-[(5-bromo-1H-indol-3-yl)methylidene]-1-(4-ethylphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STK047548
SMILES CCc1ccc(cc1)N1C(=O)NC(=O)/C(=C\c2c[nH]c3c2cc(Br)cc3)/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 C21H16BrN3O3 MW 438.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16BrN3O3/c1-2-12-3-6-15(7-4-12)25-20(27)17(19(26)24-21(25)28)9-13-11-23-18-8-5-14(22)10-16(13)18/h3-11,23H,2H2,1H3,(H,24,26,28)/b17-9+InChIKey
OPPUREUZQIWBHR-RQZCQDPDSA-NSynonyms
(5E)5((5BROMO1HINDOL3YL)METHYLIDENE)1(4ETHYLPHENYL)13DIAZINANE246TRIONE
(5E)5((5BROMO1HINDOL3YL)METHYLIDENE)1(4ETHYLPHENYL)PYRIMIDINE246(1H3H5H)TRIONE
CCC1=CC=C(C=C1)N2C(=O)C(=CC3=CNC4=C3C=C(C=C4)Br)C(=O)NC2=O
CCc1ccc(cc1)N1C(=O)NC(=O)C(=Cc2c(nH)c3c2cc(Br)cc3)C1=O
InChI=1SC21H16BrN3O3c12123615(7412)2520(27)17(19(26)2421(25)28)9131123188514(22)1016(13)18h31123H2H21H3(H242628)b179+
MFCD05041626
STK047548
ZINC000013943230
ZINC13943230
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