Vitas-M small molecule compound
1-(furan-2-ylmethyl)-2-hydroxy-5-(pyrimidin-2-ylamino)-5-(trifluoromethyl)-5,7-dihydro-1H-pyrrolo[2,3-d]pyrimidine-4,6-dione
Catalog ID
STK940467
SMILES O=C1Nc2c(C1(Nc1ncccn1)C(F)(F)F)c(=O)nc(n2Cc1ccco1)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 C16H11F3N6O4 MW 408.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H11F3N6O4/c17-16(18,19)15(24-13-20-4-2-5-21-13)9-10(22-12(15)27)25(14(28)23-11(9)26)7-8-3-1-6-29-8/h1-6H,7H2,(H,22,27)(H,20,21,24)(H,23,26,28)InChIKey
JOUNJZDJFDZDKA-UHFFFAOYSA-NSynonyms
1219562-62-51(furan2ylmethyl)2hydroxy5(pyrimidin2ylamino)5(trifluoromethyl)57dihydro1Hpyrrolo(23d)pyrimidine46dione
1(furan2ylmethyl)5(pyrimidin2ylamino)5(trifluoromethyl)7Hpyrrolo(23d)pyrimidine246trione
1219562625
C1=CN=C(N=C1)NC2(C3=C(NC2=O)N(C(=O)NC3=O)CC4=CC=CO4)C(F)(F)F
InChI=1SC16H11F3N6O4c1716(1819)15(2413204252113)910(2212(15)27)25(14(28)2311(9)26)78316298h16H7H2(H2227)(H202124)(H232628)
MFCD18179537
ZINC000101667025
ZINC000101667028
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