Vitas-M small molecule compound
2-{[2-chloro-5-(trifluoromethyl)phenyl]amino}-2-oxoethyl 4-bromo-1-methyl-1H-pyrazole-3-carboxylate
Catalog ID
STK012589
SMILES O=C(Nc1cc(ccc1Cl)C(F)(F)F)COC(=O)c1nn(cc1Br)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 C14H10BrClF3N3O3 MW 440.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H10BrClF3N3O3/c1-22-5-8(15)12(21-22)13(24)25-6-11(23)20-10-4-7(14(17,18)19)2-3-9(10)16/h2-5H,6H2,1H3,(H,20,23)InChIKey
ILKBJUYYSVCFKS-UHFFFAOYSA-NSynonyms
309724-43-4(2(2CHLORO5(TRIFLUOROMETHYL)ANILINO)2OXOETHYL)4BROMO1METHYLPYRAZOLE3CARBOXYLATE
(N(2CHLORO5(TRIFLUOROMETHYL)PHENYL)CARBAMOYL)METHYL4BROMO1METHYLPYRAZOLE3CARBOXYLATE
2((2CHLORO5(TRIFLUOROMETHYL)PHENYL)AMINO)2OXOETHYL4BROMO1METHYL1HPYRAZOLE3CARBOXYLATE
309724434
CN1C=C(C(=N1)C(=O)OCC(=O)NC2=C(C=CC(=C2)C(F)(F)F)Cl)Br
InChI=1SC14H10BrClF3N3O3c12258(15)12(2122)13(24)25611(23)201047(14(1718)19)239(10)16h25H6H21H3(H2023)
MFCD01871796
O=C(Nc1cc(ccc1Cl)C(F)(F)F)COC(=O)c1nn(cc1Br)C
STK012589
ZINC000000709336
ZINC00709336
ZINC709336
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