Vitas-M small molecule compound
(4Z)-4-{3-methoxy-4-[(2-methylbenzyl)oxy]benzylidene}-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK097329
SMILES COc1cc(ccc1OCc1ccccc1C)/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 C26H24N2O3 MW 412.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H24N2O3/c1-18-9-7-8-10-21(18)17-31-24-14-13-20(16-25(24)30-3)15-23-19(2)27-28(26(23)29)22-11-5-4-6-12-22/h4-16H,17H2,1-3H3/b23-15-InChIKey
CHCPUPHEROWFJK-HAHDFKILSA-NSynonyms
(4Z)4((3methoxy4((2methylphenyl)methoxy)phenyl)methylidene)5methyl2phenylpyrazol3one
(4Z)4(3METHOXY4((2METHYLBENZYL)OXY)BENZYLIDENE)5METHYL2PHENYL24DIHYDRO3HPYRAZOL3ONE
CC1=CC=CC=C1COC2=C(C=C(C=C2)C=C3C(=NN(C3=O)C4=CC=CC=C4)C)OC
COc1cc(ccc1OCc1ccccc1C)C=C1C(=NN(C1=O)c1ccccc1)C
InChI=1SC26H24N2O3c1189781021(18)173124141320(1625(24)303)152319(2)2728(26(23)29)22115461222h416H17H213H3b2315
MFCD03183889
STK097329
ZINC000013895746
ZINC13895746
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