Vitas-M small molecule compound
ethyl 4-[4-(3-fluorophenyl)-3-methyl-6-oxo-2,6-dihydropyrrolo[3,4-c]pyrazol-5(4H)-yl]benzoate
Catalog ID
STL056746
SMILES CCOC(=O)c1ccc(cc1)N1C(=O)c2c(C1c1cccc(c1)F)c([nH]n2)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 C21H18FN3O3 MW 379.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18FN3O3/c1-3-28-21(27)13-7-9-16(10-8-13)25-19(14-5-4-6-15(22)11-14)17-12(2)23-24-18(17)20(25)26/h4-11,19H,3H2,1-2H3,(H,23,24)InChIKey
IYWGAWSLRXEQLV-UHFFFAOYSA-NSynonyms
578720-99-7578720997
CCOC(=O)C1=CC=C(C=C1)N2C(C3=C(NN=C3C2=O)C)C4=CC(=CC=C4)F
CCOC(=O)c1ccc(cc1)N1C(=O)c2c(C1c1cccc(c1)F)c((nH)n2)C
CCOC(=O)c1ccc(cc1)N1C(c2cccc(c2)F)c2c(C1=O)(nH)nc2C
ETHYL4(4(3FLUOROPHENYL)3METHYL6OXO24DIHYDROPYRROLO(34C)PYRAZOL5YL)BENZOATE
ethyl4(4(3fluorophenyl)3methyl6oxo26dihydropyrrolo(34c)pyrazol5(4H)yl)benzoate
ETHYL4(4(3FLUOROPHENYL)3METHYL6OXO46DIHYDROPYRROLO(34C)PYRAZOL5(1H)YL)BENZOATE
ethyl4(4(3fluorophenyl)3methyl6oxopyrrolo(34c)pyrazol5(1H4H6H)yl)benzoate
InChI=1SC21H18FN3O3c132821(27)137916(10813)2519(1454615(22)1114)1712(2)232418(17)20(25)26h41119H3H212H3(H2324)
MFCD05736170
ZINC000004928847
ZINC000004928849
Check stock
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Check stock on Vitas-MAvailable files
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