Vitas-M small molecule compound
ethyl (2E)-4-{2-[(Z)-(3-methyl-5-oxo-1-phenyl-1,5-dihydro-4H-pyrazol-4-ylidene)methyl]phenoxy}but-2-enoate
Catalog ID
STL023301
SMILES CCOC(=O)/C=C/COc1ccccc1/C=C\1/C(=NN(C1=O)c1ccccc1)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 C23H22N2O4 MW 390.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22N2O4/c1-3-28-22(26)14-9-15-29-21-13-8-7-10-18(21)16-20-17(2)24-25(23(20)27)19-11-5-4-6-12-19/h4-14,16H,3,15H2,1-2H3/b14-9+,20-16-InChIKey
OLLMTUJIUZEQHQ-LLQVVRDRSA-NSynonyms
CCOC(=O)C=CCOC1=CC=CC=C1C=C2C(=NN(C2=O)C3=CC=CC=C3)C
CCOC(=O)C=CCOc1ccccc1C=C1C(=NN(C1=O)c1ccccc1)C
ETHYL(2E)4(2((3METHYL5OXO1PHENYL(12DIAZOLIN4YLIDENE))METHYL)PHENOXY)BUT2ENOATE
ethyl(2E)4(2((Z)(3methyl5oxo1phenyl15dihydro4Hpyrazol4ylidene)methyl)phenoxy)but2enoate
ethyl(E)4(2((Z)(3methyl5oxo1phenylpyrazol4ylidene)methyl)phenoxy)but2enoate
InChI=1SC23H22N2O4c132822(26)14915292113871018(21)162017(2)2425(23(20)27)19115461219h41416H315H212H3b149+2016
MFCD09760686
ZINC000011690119
ZINC11690119
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