Vitas-M small molecule compound
(4Z)-2-(3,4-dichlorophenyl)-4-[3-methoxy-4-(prop-2-en-1-yloxy)benzylidene]-5-methyl-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK331164
SMILES C=CCOc1ccc(cc1OC)/C=C\1/C(=NN(C1=O)c1ccc(c(c1)Cl)Cl)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 C21H18Cl2N2O3 MW 417.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18Cl2N2O3/c1-4-9-28-19-8-5-14(11-20(19)27-3)10-16-13(2)24-25(21(16)26)15-6-7-17(22)18(23)12-15/h4-8,10-12H,1,9H2,2-3H3/b16-10-InChIKey
JOLZQRDQYPKRJO-YBEGLDIGSA-NSynonyms
(4Z)2(34DICHLOROPHENYL)4((3METHOXY4PROP2ENOXYPHENYL)METHYLIDENE)5METHYLPYRAZOL3ONE
(4Z)2(34dichlorophenyl)4(3methoxy4(prop2en1yloxy)benzylidene)5methyl24dihydro3Hpyrazol3one
C=CCOc1ccc(cc1OC)C=C1C(=NN(C1=O)c1ccc(c(c1)Cl)Cl)C
CC1=NN(C(=O)C1=CC2=CC(=C(C=C2)OCC=C)OC)C3=CC(=C(C=C3)Cl)Cl
InChI=1SC21H18Cl2N2O3c14928198514(1120(19)273)101613(2)2425(21(16)26)156717(22)18(23)1215h481012H19H223H3b1610
MFCD09962481
ZINC000018194234
ZINC18194234
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