Vitas-M small molecule compound
2-[(3Z)-5-cyano-4-methyl-3-{[3-(4-methylphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-2,6-dioxo-3,6-dihydropyridin-1(2H)-yl]ethyl acetate
Catalog ID
STK908811
SMILES N#CC1=C(C)/C(=C/c2cn(nc2c2ccc(cc2)C)c2ccccc2)/C(=O)N(C1=O)CCOC(=O)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 C28H24N4O4 MW 480.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H24N4O4/c1-18-9-11-21(12-10-18)26-22(17-32(30-26)23-7-5-4-6-8-23)15-24-19(2)25(16-29)28(35)31(27(24)34)13-14-36-20(3)33/h4-12,15,17H,13-14H2,1-3H3/b24-15-InChIKey
FEFZRNZZLVVESN-IWIPYMOSSA-NSynonyms
2((3Z)5cyano4methyl3((3(4methylphenyl)1phenyl1Hpyrazol4yl)methylidene)26dioxo36dihydropyridin1(2H)yl)ethylacetate
2((5Z)3cyano4methyl5((3(4methylphenyl)1phenylpyrazol4yl)methylidene)26dioxopyridin1yl)ethylacetate
CC1=CC=C(C=C1)C2=NN(C=C2C=C3C(=C(C(=O)N(C3=O)CCOC(=O)C)C#N)C)C4=CC=CC=C4
InChI=1SC28H24N4O4c11891121(121018)2622(1732(3026)237546823)152419(2)25(1629)28(35)31(27(24)34)13143620(3)33h4121517H1314H213H3b2415
MFCD06648099
N#CC1=C(C)C(=Cc2cn(nc2c2ccc(cc2)C)c2ccccc2)C(=O)N(C1=O)CCOC(=O)C
ZINC000016753045
ZINC16753045
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