Vitas-M small molecule compound

methyl 4-({[1-(difluoromethyl)-1H-pyrazol-3-yl]carbonyl}amino)-1-ethyl-1H-pyrazole-3-carboxylate

Catalog ID
STL393275
SMILES COC(=O)c1nn(cc1NC(=O)c1ccn(n1)C(F)F)CC

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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 C12H13F2N5O3 MW 313.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H13F2N5O3/c1-3-18-6-8(9(17-18)11(21)22-2)15-10(20)7-4-5-19(16-7)12(13)14/h4-6,12H,3H2,1-2H3,(H,15,20)
InChIKey
FVNVXUFFPNPEKJ-UHFFFAOYSA-N
Synonyms
1005589-91-2
1005589912
CCN1C=C(C(=N1)C(=O)OC)NC(=O)C2=NN(C=C2)C(F)F
InChI=1SC12H13F2N5O3c131868(9(1718)11(21)222)1510(20)74519(167)12(13)14h4612H3H212H3(H1520)
METHYL4(((1(DIFLUOROMETHYL)1HPYRAZOL3YL)CARBONYL)AMINO)1ETHYL1HPYRAZOLE3CARBOXYLATE
METHYL4((1(DIFLUOROMETHYL)PYRAZOLE3CARBONYL)AMINO)1ETHYLPYRAZOLE3CARBOXYLATE
MFCD04052150
ZINC000002800707
ZINC02800707
ZINC2800707

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Available files

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