Vitas-M small molecule compound
3-{[1-(2,2-difluoroethyl)-3-methyl-1H-pyrazol-5-yl]carbamoyl}-1-methyl-1H-pyrazole-4-carboxylic acid
Catalog ID
STL397725
SMILES FC(Cn1nc(cc1NC(=O)c1nn(cc1C(=O)O)C)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 C12H13F2N5O3 MW 313.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H13F2N5O3/c1-6-3-9(19(16-6)5-8(13)14)15-11(20)10-7(12(21)22)4-18(2)17-10/h3-4,8H,5H2,1-2H3,(H,15,20)(H,21,22)InChIKey
FDYDFUYNAXIOKT-UHFFFAOYSA-NSynonyms
1174885-31-41174885314
3((1(22DIFLUOROETHYL)3METHYL1HPYRAZOL5YL)CARBAMOYL)1METHYL1HPYRAZOLE4CARBOXYLICACID
3((2(22difluoroethyl)5methylpyrazol3yl)carbamoyl)1methylpyrazole4carboxylicacid
CC1=NN(C(=C1)NC(=O)C2=NN(C=C2C(=O)O)C)CC(F)F
InChI=1SC12H13F2N5O3c1639(19(166)58(13)14)1511(20)107(12(21)22)418(2)1710h348H5H212H3(H1520)(H2122)
MFCD09474020
ZINC000020616226
ZINC20616226
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