Vitas-M small molecule compound
(5E)-5-{[2,5-dimethyl-1-(pyridin-4-yl)-1H-pyrrol-3-yl]methylidene}-1-(2-fluorophenyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STK176343
SMILES O=C1NC(=O)N(C(=O)/C/1=C/c1cc(n(c1C)c1ccncc1)C)c1ccccc1F
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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 C22H17FN4O3 MW 404.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17FN4O3/c1-13-11-15(14(2)26(13)16-7-9-24-10-8-16)12-17-20(28)25-22(30)27(21(17)29)19-6-4-3-5-18(19)23/h3-12H,1-2H3,(H,25,28,30)/b17-12+InChIKey
VKNMZUCCYVZESK-SFQUDFHCSA-NSynonyms
(5E)5((25DIMETHYL1(PYRIDIN4YL)1HPYRROL3YL)METHYLIDENE)1(2FLUOROPHENYL)PYRIMIDINE246(1H3H5H)TRIONE
(5E)5((25DIMETHYL1PYRIDIN4YLPYRROL3YL)METHYLIDENE)1(2FLUOROPHENYL)13DIAZINANE246TRIONE
CC1=CC(=C(N1C2=CC=NC=C2)C)C=C3C(=O)NC(=O)N(C3=O)C4=CC=CC=C4F
InChI=1SC22H17FN4O3c1131115(14(2)26(13)16792410816)121720(28)2522(30)27(21(17)29)19643518(19)23h312H12H3(H252830)b1712+
MFCD03704877
O=C1NC(=O)N(C(=O)C1=Cc1cc(n(c1C)c1ccncc1)C)c1ccccc1F
ZINC000001093854
ZINC01093854
ZINC1093854
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