Vitas-M small molecule compound
(4Z)-4-[3-chloro-5-ethoxy-4-(prop-2-en-1-yloxy)benzylidene]-5-methyl-2-[3-(trifluoromethyl)phenyl]-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK958473
SMILES C=CCOc1c(Cl)cc(cc1OCC)/C=C\1/C(=NN(C1=O)c1cccc(c1)C(F)(F)F)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 C23H20ClF3N2O3 MW 464.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H20ClF3N2O3/c1-4-9-32-21-19(24)11-15(12-20(21)31-5-2)10-18-14(3)28-29(22(18)30)17-8-6-7-16(13-17)23(25,26)27/h4,6-8,10-13H,1,5,9H2,2-3H3/b18-10-InChIKey
ZBJBCSJTVONKMX-ZDLGFXPLSA-NSynonyms
445254-20-6(4Z)4((3chloro5ethoxy4prop2enoxyphenyl)methylidene)5methyl2(3(trifluoromethyl)phenyl)pyrazol3one
(4Z)4(3chloro5ethoxy4(prop2en1yloxy)benzylidene)5methyl2(3(trifluoromethyl)phenyl)24dihydro3Hpyrazol3one
4(4(ALLYLOXY)3CHLORO5ETHOXYBENZYLIDENE)5METHYL2(3(TRIFLUOROMETHYL)PHENYL)24DIHYDRO3HPYRAZOL3ONE
445254206
C=CCOc1c(Cl)cc(cc1OCC)C=C1C(=NN(C1=O)c1cccc(c1)C(F)(F)F)C
CCOC1=C(C(=CC(=C1)C=C2C(=NN(C2=O)C3=CC=CC(=C3)C(F)(F)F)C)Cl)OCC=C
InChI=1SC23H20ClF3N2O3c149322119(24)1115(1220(21)3152)101814(3)2829(22(18)30)1786716(1317)23(2526)27h4681013H159H223H3b1810
MFCD02054577
ZINC000008443807
ZINC08443807
ZINC8443807
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