Vitas-M small molecule compound
methyl [(4Z)-4-{1-[(2,3-dimethoxyphenyl)amino]ethylidene}-1-(4-fluorophenyl)-5-oxo-4,5-dihydro-1H-pyrazol-3-yl]acetate
Catalog ID
STK234796
SMILES COC(=O)CC1=NN(C(=O)/C/1=C(\Nc1cccc(c1OC)OC)/C)c1ccc(cc1)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 C22H22FN3O5 MW 427.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22FN3O5/c1-13(24-16-6-5-7-18(29-2)21(16)31-4)20-17(12-19(27)30-3)25-26(22(20)28)15-10-8-14(23)9-11-15/h5-11,24H,12H2,1-4H3/b20-13-InChIKey
PUULTIPMKJIUBP-MOSHPQCFSA-NSynonyms
CC(=C1C(=NN(C1=O)C2=CC=C(C=C2)F)CC(=O)OC)NC3=C(C(=CC=C3)OC)OC
COC(=O)CC1=NN(C(=O)C1=C(Nc1cccc(c1OC)OC)C)c1ccc(cc1)F
InChI=1SC22H22FN3O5c113(241665718(292)21(16)314)2017(1219(27)303)2526(22(20)28)1510814(23)91115h51124H12H214H3b2013
methyl((4Z)4(1((23dimethoxyphenyl)amino)ethylidene)1(4fluorophenyl)5oxo45dihydro1Hpyrazol3yl)acetate
METHYL2((4Z)4(1(23DIMETHOXYANILINO)ETHYLIDENE)1(4FLUOROPHENYL)5OXOPYRAZOL3YL)ACETATE
METHYL2(4(((23DIMETHOXYPHENYL)AMINO)ETHYLIDENE)1(4FLUOROPHENYL)5OXO12DIAZOLIN3YL)ACETATE
MFCD07598152
ZINC000009191943
ZINC09191943
ZINC9191943
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Check stock on Vitas-MAvailable files
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