Vitas-M small molecule compound
(4Z)-2-benzyl-4-[3-(benzyloxy)-4-methoxybenzylidene]-5-methyl-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK331922
SMILES COc1ccc(cc1OCc1ccccc1)/C=C\1/C(=NN(C1=O)Cc1ccccc1)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/c1-19-23(26(29)28(27-19)17-20-9-5-3-6-10-20)15-22-13-14-24(30-2)25(16-22)31-18-21-11-7-4-8-12-21/h3-16H,17-18H2,1-2H3/b23-15-InChIKey
NXZSMLUGKGQRHF-HAHDFKILSA-NSynonyms
(4Z)2benzyl4((4methoxy3phenylmethoxyphenyl)methylidene)5methylpyrazol3one
(4Z)2benzyl4(3(benzyloxy)4methoxybenzylidene)5methyl24dihydro3Hpyrazol3one
CC1=NN(C(=O)C1=CC2=CC(=C(C=C2)OC)OCC3=CC=CC=C3)CC4=CC=CC=C4
COc1ccc(cc1OCc1ccccc1)C=C1C(=NN(C1=O)Cc1ccccc1)C
InChI=1SC26H24N2O3c11923(26(29)28(2719)172095361020)1522131424(302)25(1622)311821117481221h316H1718H212H3b2315
MFCD09962640
ZINC000018194718
ZINC18194718
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