Vitas-M small molecule compound
ethyl 4-{(4Z)-4-[(2E)-3-(furan-2-yl)prop-2-en-1-ylidene]-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl}benzoate
Catalog ID
STL432586
SMILES CCOC(=O)c1ccc(cc1)N1N=C(/C(=C/C=C/c2ccco2)/C1=O)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 C20H18N2O4 MW 350.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18N2O4/c1-3-25-20(24)15-9-11-16(12-10-15)22-19(23)18(14(2)21-22)8-4-6-17-7-5-13-26-17/h4-13H,3H2,1-2H3/b6-4+,18-8-InChIKey
GNYUDIWDYSREAL-VDZUBFLMSA-NSynonyms
CCOC(=O)C1=CC=C(C=C1)N2C(=O)C(=CC=CC3=CC=CO3)C(=N2)C
CCOC(=O)c1ccc(cc1)N1N=C(C(=CC=Cc2ccco2)C1=O)C
ethyl4((4Z)4((2E)3(furan2yl)prop2en1ylidene)3methyl5oxo45dihydro1Hpyrazol1yl)benzoate
ETHYL4((4Z)4((E)3(FURAN2YL)PROP2ENYLIDENE)3METHYL5OXOPYRAZOL1YL)BENZOATE
ETHYL4(4(3(2FURYL)2PROPENYLIDENE)3METHYL5OXO45DIHYDRO1HPYRAZOL1YL)BENZOATE
InChI=1SC20H18N2O4c132520(24)1591116(121015)2219(23)18(14(2)2122)8461775132617h413H3H212H3b64+188
MFCD02951693
ZINC000004658830
ZINC04658830
ZINC4658830
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