Vitas-M small molecule compound
(4Z)-4-(3,4-diethoxybenzylidene)-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK362499
SMILES CCOc1cc(ccc1OCC)/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 C21H22N2O3 MW 350.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N2O3/c1-4-25-19-12-11-16(14-20(19)26-5-2)13-18-15(3)22-23(21(18)24)17-9-7-6-8-10-17/h6-14H,4-5H2,1-3H3/b18-13-InChIKey
YFFVSXVQZUMKAY-AQTBWJFISA-NSynonyms
(4Z)4((34DIETHOXYPHENYL)METHYLIDENE)5METHYL2PHENYLPYRAZOL3ONE
(4Z)4(34DIETHOXYBENZYLIDENE)5METHYL2PHENYL24DIHYDRO3HPYRAZOL3ONE
CCOC1=C(C=C(C=C1)C=C2C(=NN(C2=O)C3=CC=CC=C3)C)OCC
CCOc1cc(ccc1OCC)C=C1C(=NN(C1=O)c1ccccc1)C
InChI=1SC21H22N2O3c142519121116(1420(19)2652)131815(3)2223(21(18)24)1797681017h614H45H213H3b1813
MFCD01360064
ZINC000015938856
ZINC15938856
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