Vitas-M small molecule compound
4-[(E)-{2-[(3-methyl-1H-pyrazol-5-yl)carbonyl]hydrazinylidene}methyl]phenyl 4-methoxybenzoate
Catalog ID
STK249313
SMILES COc1ccc(cc1)C(=O)Oc1ccc(cc1)/C=N/NC(=O)c1[nH]nc(c1)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 C20H18N4O4 MW 378.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18N4O4/c1-13-11-18(23-22-13)19(25)24-21-12-14-3-7-17(8-4-14)28-20(26)15-5-9-16(27-2)10-6-15/h3-12H,1-2H3,(H,22,23)(H,24,25)/b21-12+InChIKey
WRLXVKNLBBDCOE-CIAFOILYSA-NSynonyms
(4((E)((5methyl1Hpyrazole3carbonyl)hydrazinylidene)methyl)phenyl)4methoxybenzoate4((E)(2((3methyl1Hpyrazol5yl)carbonyl)hydrazinylidene)methyl)phenyl4methoxybenzoate
CC1=CC(=NN1)C(=O)NN=CC2=CC=C(C=C2)OC(=O)C3=CC=C(C=C3)OC
COc1ccc(cc1)C(=O)Oc1ccc(cc1)C=NNC(=O)c1(nH)nc(c1)C
Registry IDs
MFCD08685009ZINC000008026424
ZINC98031317
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