Vitas-M small molecule compound
(5Z)-1-ethyl-5-{[3-(3-fluoro-4-methylphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-4-methyl-2,6-dioxo-1,2,5,6-tetrahydropyridine-3-carbonitrile
Catalog ID
STK514843
SMILES CCN1C(=O)/C(=C\c2cn(nc2c2ccc(c(c2)F)C)c2ccccc2)/C(=C(C1=O)C#N)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 C26H21FN4O2 MW 440.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H21FN4O2/c1-4-30-25(32)21(17(3)22(14-28)26(30)33)12-19-15-31(20-8-6-5-7-9-20)29-24(19)18-11-10-16(2)23(27)13-18/h5-13,15H,4H2,1-3H3/b21-12-InChIKey
VDHVQUXDBZKJGK-MTJSOVHGSA-NSynonyms
(5Z)1ethyl5((3(3fluoro4methylphenyl)1phenyl1Hpyrazol4yl)methylidene)4methyl26dioxo1256tetrahydropyridine3carbonitrile
(5Z)1ethyl5((3(3fluoro4methylphenyl)1phenylpyrazol4yl)methylidene)4methyl26dioxopyridine3carbonitrile
CCN1C(=O)C(=CC2=CN(N=C2C3=CC(=C(C=C3)C)F)C4=CC=CC=C4)C(=C(C1=O)C#N)C
CCN1C(=O)C(=Cc2cn(nc2c2ccc(c(c2)F)C)c2ccccc2)C(=C(C1=O)C#N)C
InChI=1SC26H21FN4O2c143025(32)21(17(3)22(1428)26(30)33)12191531(208657920)2924(19)18111016(2)23(27)1318h51315H4H213H3b2112
MFCD06645006
ZINC000016741520
ZINC16741520
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