Vitas-M small molecule compound
methyl [(4Z)-1-(4-methoxyphenyl)-4-{1-[(3-methylpyridin-2-yl)amino]ethylidene}-5-oxo-4,5-dihydro-1H-pyrazol-3-yl]acetate
Catalog ID
STK234785
SMILES COC(=O)CC1=NN(C(=O)/C/1=C(\Nc1ncccc1C)/C)c1ccc(cc1)OC
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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 C21H22N4O4 MW 394.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N4O4/c1-13-6-5-11-22-20(13)23-14(2)19-17(12-18(26)29-4)24-25(21(19)27)15-7-9-16(28-3)10-8-15/h5-11H,12H2,1-4H3,(H,22,23)/b19-14-InChIKey
CBZCEBXAEXYPEJ-RGEXLXHISA-NSynonyms
(Z)methyl2(1(4methoxyphenyl)4(1((3methylpyridin2yl)amino)ethylidene)5oxo45dihydro1Hpyrazol3yl)acetate
CC1=C(N=CC=C1)NC(=C2C(=NN(C2=O)C3=CC=C(C=C3)OC)CC(=O)OC)C
COC(=O)CC1=NN(C(=O)C1=C(Nc1ncccc1C)C)c1ccc(cc1)OC
InChI=1SC21H22N4O4c11365112220(13)2314(2)1917(1218(26)294)2425(21(19)27)157916(283)10815h511H12H214H3(H2223)b1914
methyl((4Z)1(4methoxyphenyl)4(1((3methylpyridin2yl)amino)ethylidene)5oxo45dihydro1Hpyrazol3yl)acetate
METHYL2((4Z)1(4METHOXYPHENYL)4(1((3METHYLPYRIDIN2YL)AMINO)ETHYLIDENE)5OXOPYRAZOL3YL)ACETATE
METHYL2(1(4METHOXYPHENYL)4(((3METHYL(2PYRIDYL))AMINO)ETHYLIDENE)5OXO12DIAZOLIN3YL)ACETATE
MFCD07792748
ZINC000100423618
ZINC100423618
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