Vitas-M small molecule compound
methyl 6-amino-5-cyano-2-methyl-4-[2-(trifluoromethyl)phenyl]-4H-pyran-3-carboxylate
Catalog ID
STK747520
SMILES COC(=O)C1=C(C)OC(=C(C1c1ccccc1C(F)(F)F)C#N)N
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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 C16H13F3N2O3 MW 338.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13F3N2O3/c1-8-12(15(22)23-2)13(10(7-20)14(21)24-8)9-5-3-4-6-11(9)16(17,18)19/h3-6,13H,21H2,1-2H3InChIKey
MBFPIVAZVAPGQL-UHFFFAOYSA-NSynonyms
CC1=C(C(C(=C(O1)N)C#N)C2=CC=CC=C2C(F)(F)F)C(=O)OC
InChI=1SC16H13F3N2O3c1812(15(22)232)13(10(720)14(21)248)9534611(9)16(1718)19h3613H21H212H3
methyl6amino5cyano2methyl4(2(trifluoromethyl)phenyl)4Hpyran3carboxylate
MFCD00742420
ZINC000000049998
ZINC000000049999
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