Vitas-M small molecule compound
(4Z)-4-[5-bromo-2-(prop-2-en-1-yloxy)benzylidene]-2-(4-chlorophenyl)-5-methyl-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STL171831
SMILES C=CCOc1ccc(cc1/C=C\1/C(=NN(C1=O)c1ccc(cc1)Cl)C)Br
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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 C20H16BrClN2O2 MW 431.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16BrClN2O2/c1-3-10-26-19-9-4-15(21)11-14(19)12-18-13(2)23-24(20(18)25)17-7-5-16(22)6-8-17/h3-9,11-12H,1,10H2,2H3/b18-12-InChIKey
DODPBQFRKSZQEO-PDGQHHTCSA-NSynonyms
(4Z)4((5BROMO2PROP2ENOXYPHENYL)METHYLIDENE)2(4CHLOROPHENYL)5METHYLPYRAZOL3ONE
(4Z)4(5bromo2(prop2en1yloxy)benzylidene)2(4chlorophenyl)5methyl24dihydro3Hpyrazol3one
C=CCOc1ccc(cc1C=C1C(=NN(C1=O)c1ccc(cc1)Cl)C)Br
CC1=NN(C(=O)C1=CC2=C(C=CC(=C2)Br)OCC=C)C3=CC=C(C=C3)Cl
InChI=1SC20H16BrClN2O2c131026199415(21)1114(19)121813(2)2324(20(18)25)177516(22)6817h391112H110H22H3b1812
MFCD01835300
ZINC000013914967
ZINC13914967
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