Vitas-M small molecule compound
(5Z)-1-cyclopentyl-4-methyl-5-{[3-(4-methylphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-2,6-dioxo-1,2,5,6-tetrahydropyridine-3-carbonitrile
Catalog ID
STK908830
SMILES N#CC1=C(C)/C(=C/c2cn(nc2c2ccc(cc2)C)c2ccccc2)/C(=O)N(C1=O)C1CCCC1
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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 C29H26N4O2 MW 462.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H26N4O2/c1-19-12-14-21(15-13-19)27-22(18-32(31-27)23-8-4-3-5-9-23)16-25-20(2)26(17-30)29(35)33(28(25)34)24-10-6-7-11-24/h3-5,8-9,12-16,18,24H,6-7,10-11H2,1-2H3/b25-16-InChIKey
RWLQIEVBOVHRDR-XYGWBWBKSA-NSynonyms
(5Z)1cyclopentyl4methyl5((3(4methylphenyl)1phenyl1Hpyrazol4yl)methylidene)26dioxo1256tetrahydropyridine3carbonitrile
(5Z)1cyclopentyl4methyl5((3(4methylphenyl)1phenylpyrazol4yl)methylidene)26dioxopyridine3carbonitrile
CC1=CC=C(C=C1)C2=NN(C=C2C=C3C(=C(C(=O)N(C3=O)C4CCCC4)C#N)C)C5=CC=CC=C5
InChI=1SC29H26N4O2c119121421(151319)2722(1832(3127)238435923)162520(2)26(1730)29(35)33(28(25)34)2410671124h358912161824H671011H212H3b2516
MFCD06648118
N#CC1=C(C)C(=Cc2cn(nc2c2ccc(cc2)C)c2ccccc2)C(=O)N(C1=O)C1CCCC1
ZINC000016753093
ZINC16753093
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