Vitas-M small molecule compound
(4E)-4-(3-methoxy-4-propoxybenzylidene)-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK956959
SMILES CCCOc1ccc(cc1OC)/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/c1-4-12-26-19-11-10-16(14-20(19)25-3)13-18-15(2)22-23(21(18)24)17-8-6-5-7-9-17/h5-11,13-14H,4,12H2,1-3H3/b18-13+InChIKey
VROWNZSGTIPHBO-QGOAFFKASA-NSynonyms
(4E)4((3METHOXY4PROPOXYPHENYL)METHYLIDENE)5METHYL2PHENYLPYRAZOL3ONE
(4E)4(3methoxy4propoxybenzylidene)5methyl2phenyl24dihydro3Hpyrazol3one
4(3METHOXY4PROPOXYBENZYLIDENE)5METHYL2PHENYL24DIHYDRO3HPYRAZOL3ONE
CCCOC1=C(C=C(C=C1)C=C2C(=NN(C2=O)C3=CC=CC=C3)C)OC
CCCOc1ccc(cc1OC)C=C1C(=NN(C1=O)c1ccccc1)C
InChI=1SC21H22N2O3c14122619111016(1420(19)253)131815(2)2223(21(18)24)178657917h5111314H412H213H3b1813+
MFCD00849464
ZINC000004610937
ZINC04610937
ZINC4610937
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