Vitas-M small molecule compound

6-(trifluoromethyl)-4-{(E)-2-[2-(trifluoromethyl)phenyl]ethenyl}pyrimidin-2(1H)-one

Catalog ID
STK394302
SMILES O=c1nc(/C=C/c2ccccc2C(F)(F)F)cc([nH]1)C(F)(F)F

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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 C14H8F6N2O MW 334.22 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H8F6N2O/c15-13(16,17)10-4-2-1-3-8(10)5-6-9-7-11(14(18,19)20)22-12(23)21-9/h1-7H,(H,21,22,23)/b6-5+
InChIKey
ICPGIBOUOUKJRO-AATRIKPKSA-N
Synonyms
296792-89-7
296792897
4(TRIFLUOROMETHYL)6((E)2(2(TRIFLUOROMETHYL)PHENYL)ETHENYL)2(3H)PYRIMIDINONE
4TRIFLUOROMETHYL6(2(2TRIFLUOROMETHYLPHENYL)VINYL)1HPYRIMIDIN2ONE
6((1E)2(2(TRIFLUOROMETHYL)PHENYL)VINYL)4(TRIFLUOROMETHYL)3HYDROPYRIMIDIN2ONE
6(TRIFLUOROMETHYL)4((E)2(2(TRIFLUOROMETHYL)PHENYL)ETHENYL)1HPYRIMIDIN2ONE
6(trifluoromethyl)4((E)2(2(trifluoromethyl)phenyl)ethenyl)pyrimidin2(1H)one
6(TRIFLUOROMETHYL)4((E)2(2(TRIFLUOROMETHYL)PHENYL)VINYL)1HPYRIMIDIN2ONE
C1=CC=C(C(=C1)C=CC2=NC(=O)NC(=C2)C(F)(F)F)C(F)(F)F
InChI=1SC14H8F6N2Oc1513(1617)1042138(10)569711(14(1819)20)2212(23)219h17H(H212223)b65+
MFCD01360074
O=c1nc(C=Cc2ccccc2C(F)(F)F)cc((nH)1)C(F)(F)F
PYRIMIDIN2(1H)ONE6TRIFLUOROMETHYL4(2(2TRIFLUOROMETHYLPHENYL)ETHENYL)
ZINC000012375272
ZINC12375272

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Available files

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