Vitas-M small molecule compound
ethyl 3-(5-methyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-5-(trifluoromethyl)thiophene-2-carboxylate
Catalog ID
STK627017
SMILES CCOC(=O)c1sc(cc1c1c(C)[nH]n(c1=O)c1ccccc1)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 C18H15F3N2O3S MW 396.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H15F3N2O3S/c1-3-26-17(25)15-12(9-13(27-15)18(19,20)21)14-10(2)22-23(16(14)24)11-7-5-4-6-8-11/h4-9,22H,3H2,1-2H3InChIKey
DXXNJGUDNYVELR-UHFFFAOYSA-NSynonyms
928819-62-9928819629
CCOC(=O)C1=C(C=C(S1)C(F)(F)F)C2=C(NN(C2=O)C3=CC=CC=C3)C
CCOC(=O)c1sc(cc1c1c(C)(nH)n(c1=O)c1ccccc1)C(F)(F)F
ethyl3(5methyl3oxo2phenyl1Hpyrazol4yl)5(trifluoromethyl)thiophene2carboxylate
ethyl3(5methyl3oxo2phenyl23dihydro1Hpyrazol4yl)5(trifluoromethyl)thiophene2carboxylate
InChI=1SC18H15F3N2O3Sc132617(25)1512(913(2715)18(1920)21)1410(2)2223(16(14)24)117546811h4922H3H212H3
MFCD09796976
ZINC000009341579
ZINC09341579
ZINC101455976
ZINC9341579
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