Vitas-M small molecule compound
(5Z)-1-[2-(3,4-dimethoxyphenyl)ethyl]-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
STK908611
SMILES N#CC1=C(C)/C(=C/c2cn(nc2c2ccc(cc2)C)c2ccccc2)/C(=O)N(C1=O)CCc1ccc(c(c1)OC)OC
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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 C34H30N4O4 MW 558.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H30N4O4/c1-22-10-13-25(14-11-22)32-26(21-38(36-32)27-8-6-5-7-9-27)19-28-23(2)29(20-35)34(40)37(33(28)39)17-16-24-12-15-30(41-3)31(18-24)42-4/h5-15,18-19,21H,16-17H2,1-4H3/b28-19-InChIKey
KBRWRPQLVOEEBD-USHMODERSA-NSynonyms
(5Z)1(2(34dimethoxyphenyl)ethyl)4methyl5((3(4methylphenyl)1phenyl1Hpyrazol4yl)methylidene)26dioxo1256tetrahydropyridine3carbonitrile
(5Z)1(2(34dimethoxyphenyl)ethyl)4methyl5((3(4methylphenyl)1phenylpyrazol4yl)methylidene)26dioxopyridine3carbonitrile
CC1=CC=C(C=C1)C2=NN(C=C2C=C3C(=C(C(=O)N(C3=O)CCC4=CC(=C(C=C4)OC)OC)C#N)C)C5=CC=CC=C5
InChI=1SC34H30N4O4c122101325(141122)3226(2138(3632)278657927)192823(2)29(2035)34(40)37(33(28)39)171624121530(413)31(1824)424h515181921H1617H214H3b2819
MFCD06647960
N#CC1=C(C)C(=Cc2cn(nc2c2ccc(cc2)C)c2ccccc2)C(=O)N(C1=O)CCc1ccc(c(c1)OC)OC
ZINC000097946818
ZINC97946818
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