Vitas-M small molecule compound
(4Z)-2,5-diphenyl-4-{[1-phenyl-3-(4-propoxyphenyl)-1H-pyrazol-4-yl]methylidene}-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK823489
SMILES CCCOc1ccc(cc1)c1nn(cc1/C=C\1/C(=NN(C1=O)c1ccccc1)c1ccccc1)c1ccccc1
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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 C34H28N4O2 MW 524.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H28N4O2/c1-2-22-40-30-20-18-26(19-21-30)32-27(24-37(35-32)28-14-8-4-9-15-28)23-31-33(25-12-6-3-7-13-25)36-38(34(31)39)29-16-10-5-11-17-29/h3-21,23-24H,2,22H2,1H3/b31-23-InChIKey
WCEOFRKELRRQAN-SXBRIOAWSA-NSynonyms
(4Z)25diphenyl4((1phenyl3(4propoxyphenyl)1Hpyrazol4yl)methylidene)24dihydro3Hpyrazol3one
(4Z)25diphenyl4((1phenyl3(4propoxyphenyl)pyrazol4yl)methylidene)pyrazol3one
CCCOC1=CC=C(C=C1)C2=NN(C=C2C=C3C(=NN(C3=O)C4=CC=CC=C4)C5=CC=CC=C5)C6=CC=CC=C6
CCCOc1ccc(cc1)c1nn(cc1C=C1C(=NN(C1=O)c1ccccc1)c1ccccc1)c1ccccc1
InChI=1SC34H28N4O2c12224030201826(192130)3227(2437(3532)28148491528)233133(25126371325)3638(34(31)39)2916105111729h3212324H222H21H3b3123
MFCD03463994
ZINC000027019838
ZINC27019838
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