Vitas-M small molecule compound
(2E)-1-[3-(difluoromethoxy)phenyl]-3-(1,3,5-trimethyl-1H-pyrazol-4-yl)prop-2-en-1-one
Catalog ID
STL402209
SMILES FC(Oc1cccc(c1)C(=O)/C=C/c1c(C)nn(c1C)C)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 C16H16F2N2O2 MW 306.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16F2N2O2/c1-10-14(11(2)20(3)19-10)7-8-15(21)12-5-4-6-13(9-12)22-16(17)18/h4-9,16H,1-3H3/b8-7+InChIKey
WIJXPKCFSGPGPO-BQYQJAHWSA-NSynonyms
1005696-52-5(2E)1(3(difluoromethoxy)phenyl)3(135trimethyl1Hpyrazol4yl)prop2en1one
(E)1(3(DIFLUOROMETHOXY)PHENYL)3(135TRIMETHYLPYRAZOL4YL)PROP2EN1ONE
1005696525
CC1=C(C(=NN1C)C)C=CC(=O)C2=CC(=CC=C2)OC(F)F
FC(Oc1cccc(c1)C(=O)C=Cc1c(C)nn(c1C)C)F
InChI=1SC16H16F2N2O2c11014(11(2)20(3)1910)7815(21)1254613(912)2216(17)18h4916H13H3b87+
MFCD04046207
ZINC000006526092
ZINC06526092
ZINC6526092
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