Vitas-M small molecule compound
(4Z)-1-(3,5-dichlorophenyl)-4-[3-ethoxy-4-(prop-2-yn-1-yloxy)benzylidene]pyrazolidine-3,5-dione
Catalog ID
STL444670
SMILES C#CCOc1ccc(cc1OCC)/C=C\1/C(=O)NN(C1=O)c1cc(Cl)cc(c1)Cl
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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 C21H16Cl2N2O4 MW 431.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16Cl2N2O4/c1-3-7-29-18-6-5-13(9-19(18)28-4-2)8-17-20(26)24-25(21(17)27)16-11-14(22)10-15(23)12-16/h1,5-6,8-12H,4,7H2,2H3,(H,24,26)/b17-8-InChIKey
CDTPZZXEMDNEOV-IUXPMGMMSA-NSynonyms
(4Z)1(35DICHLOROPHENYL)4((3ETHOXY4PROP2YNOXYPHENYL)METHYLIDENE)PYRAZOLIDINE35DIONE
(4Z)1(35dichlorophenyl)4(3ethoxy4(prop2yn1yloxy)benzylidene)pyrazolidine35dione
C#CCOc1ccc(cc1OCC)C=C1C(=O)NN(C1=O)c1cc(Cl)cc(c1)Cl
CCOC1=C(C=CC(=C1)C=C2C(=O)NN(C2=O)C3=CC(=CC(=C3)Cl)Cl)OCC#C
InChI=1SC21H16Cl2N2O4c13729186513(919(18)2842)81720(26)2425(21(17)27)161114(22)1015(23)1216h156812H47H22H3(H2426)b178
MFCD03217338
ZINC000016192471
ZINC16192471
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