Vitas-M small molecule compound
(4Z)-4-(4-butoxy-3-methoxybenzylidene)-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STL431246
SMILES CCCCOc1ccc(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 C22H24N2O3 MW 364.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24N2O3/c1-4-5-13-27-20-12-11-17(15-21(20)26-3)14-19-16(2)23-24(22(19)25)18-9-7-6-8-10-18/h6-12,14-15H,4-5,13H2,1-3H3/b19-14-InChIKey
UXXIGYLSOGGOSD-RGEXLXHISA-NSynonyms
(4Z)4((4butoxy3methoxyphenyl)methylidene)5methyl2phenylpyrazol3one
(4Z)4(4butoxy3methoxybenzylidene)5methyl2phenyl24dihydro3Hpyrazol3one
CCCCOC1=C(C=C(C=C1)C=C2C(=NN(C2=O)C3=CC=CC=C3)C)OC
CCCCOc1ccc(cc1OC)C=C1C(=NN(C1=O)c1ccccc1)C
InChI=1SC22H24N2O3c145132720121117(1521(20)263)141916(2)2324(22(19)25)1897681018h6121415H4513H213H3b1914
MFCD01053816
ZINC000005420696
ZINC05420696
ZINC5420696
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