Vitas-M small molecule compound

ethyl 1-[4-(furan-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]-5-methyl-1H-pyrazole-4-carboxylate

Catalog ID
STL400612
SMILES CCOC(=O)c1cnn(c1C)c1nc(cc(n1)C(F)(F)F)c1ccco1

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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 C16H13F3N4O3 MW 366.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13F3N4O3/c1-3-25-14(24)10-8-20-23(9(10)2)15-21-11(12-5-4-6-26-12)7-13(22-15)16(17,18)19/h4-8H,3H2,1-2H3
InChIKey
PWRKLZCGKZJRRH-UHFFFAOYSA-N
Synonyms
1005690-51-6
1005690516
CCOC(=O)C1=C(N(N=C1)C2=NC(=CC(=N2)C(F)(F)F)C3=CC=CO3)C
ethyl1(4(furan2yl)6(trifluoromethyl)pyrimidin2yl)5methyl1Hpyrazole4carboxylate
ethyl1(4(furan2yl)6(trifluoromethyl)pyrimidin2yl)5methylpyrazole4carboxylate
InChI=1SC16H13F3N4O3c132514(24)1082023(9(10)2)152111(125462612)713(2215)16(1718)19h48H3H212H3
MFCD04138218
ZINC000002809704
ZINC02809704
ZINC2809704

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.