Vitas-M small molecule compound
benzyl 6-amino-5-cyano-4-(2,4-difluorophenyl)-2-methyl-4H-pyran-3-carboxylate
Catalog ID
STK790762
SMILES N#CC1=C(N)OC(=C(C1c1ccc(cc1F)F)C(=O)OCc1ccccc1)C
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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 C21H16F2N2O3 MW 382.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16F2N2O3/c1-12-18(21(26)27-11-13-5-3-2-4-6-13)19(16(10-24)20(25)28-12)15-8-7-14(22)9-17(15)23/h2-9,19H,11,25H2,1H3InChIKey
YESOQWLKQNRNSH-UHFFFAOYSA-NSynonyms
311326-49-5311326495
benzyl6amino5cyano4(24difluorophenyl)2methyl4Hpyran3carboxylate
CC1=C(C(C(=C(O1)N)C#N)C2=C(C=C(C=C2)F)F)C(=O)OCC3=CC=CC=C3
InChI=1SC21H16F2N2O3c11218(21(26)2711135324613)19(16(1024)20(25)2812)158714(22)917(15)23h2919H1125H21H3
MFCD00827048
ZINC000000706176
ZINC000000706177
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