Vitas-M small molecule compound
2-ethoxy-4-[(E)-{2-[(3-methyl-1H-pyrazol-5-yl)carbonyl]hydrazinylidene}methyl]phenyl 4-fluorobenzoate
Catalog ID
STK012358
SMILES CCOc1cc(/C=N/NC(=O)c2[nH]nc(c2)C)ccc1OC(=O)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 C21H19FN4O4 MW 410.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19FN4O4/c1-3-29-19-11-14(12-23-26-20(27)17-10-13(2)24-25-17)4-9-18(19)30-21(28)15-5-7-16(22)8-6-15/h4-12H,3H2,1-2H3,(H,24,25)(H,26,27)/b23-12+InChIKey
AZJGPDQCVHTANO-FSJBWODESA-NSynonyms
(2ethoxy4((E)((5methyl1Hpyrazole3carbonyl)hydrazinylidene)methyl)phenyl)4fluorobenzoate
2ETHOXY4((E)(2((3METHYL1HPYRAZOL5YL)CARBONYL)HYDRAZINYLIDENE)METHYL)PHENYL4FLUOROBENZOATE
CCOC1=C(C=CC(=C1)C=NNC(=O)C2=NNC(=C2)C)OC(=O)C3=CC=C(C=C3)F
CCOc1cc(C=NNC(=O)c2(nH)nc(c2)C)ccc1OC(=O)c1ccc(cc1)F
InChI=1SC21H19FN4O4c1329191114(12232620(27)171013(2)242517)4918(19)3021(28)155716(22)8615h412H3H212H3(H2425)(H2627)b2312+
MFCD03213868
STK012358
ZINC000004551508
ZINC33652127
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