Vitas-M small molecule compound
(2E)-1-[3-(difluoromethoxy)phenyl]-3-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)prop-2-en-1-one
Catalog ID
STL403389
SMILES CCn1nc(c(c1C)/C=C/C(=O)c1cccc(c1)OC(F)F)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 C17H18F2N2O2 MW 320.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H18F2N2O2/c1-4-21-12(3)15(11(2)20-21)8-9-16(22)13-6-5-7-14(10-13)23-17(18)19/h5-10,17H,4H2,1-3H3/b9-8+InChIKey
XMQRUZUHAPEWGS-CMDGGOBGSA-NSynonyms
1005605-83-3(2E)1(3(difluoromethoxy)phenyl)3(1ethyl35dimethyl1Hpyrazol4yl)prop2en1one
(E)1(3(DIFLUOROMETHOXY)PHENYL)3(1ETHYL35DIMETHYLPYRAZOL4YL)PROP2EN1ONE
1005605833
CCN1C(=C(C(=N1)C)C=CC(=O)C2=CC(=CC=C2)OC(F)F)C
CCn1nc(c(c1C)C=CC(=O)c1cccc(c1)OC(F)F)C
InChI=1SC17H18F2N2O2c142112(3)15(11(2)2021)8916(22)1365714(1013)2317(18)19h51017H4H213H3b98+
MFCD04046208
ZINC000006490001
ZINC06490001
ZINC6490001
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