Vitas-M small molecule compound
(5Z)-1-[2-(3,4-dimethoxyphenyl)ethyl]-5-{[3-(4-ethoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-4-methyl-2,6-dioxo-1,2,5,6-tetrahydropyridine-3-carbonitrile
Catalog ID
STK908612
SMILES CCOc1ccc(cc1)c1nn(cc1/C=C/1\C(=O)N(CCc2ccc(c(c2)OC)OC)C(=O)C(=C1C)C#N)c1ccccc1
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We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C35H32N4O5 MW 588.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H32N4O5/c1-5-44-28-14-12-25(13-15-28)33-26(22-39(37-33)27-9-7-6-8-10-27)20-29-23(2)30(21-36)35(41)38(34(29)40)18-17-24-11-16-31(42-3)32(19-24)43-4/h6-16,19-20,22H,5,17-18H2,1-4H3/b29-20-InChIKey
XRPNAGMLNRGIGU-BRPDVVIDSA-NSynonyms
(5Z)1(2(34dimethoxyphenyl)ethyl)5((3(4ethoxyphenyl)1phenyl1Hpyrazol4yl)methylidene)4methyl26dioxo1256tetrahydropyridine3carbonitrile
(5Z)1(2(34dimethoxyphenyl)ethyl)5((3(4ethoxyphenyl)1phenylpyrazol4yl)methylidene)4methyl26dioxopyridine3carbonitrile
CCOC1=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
CCOc1ccc(cc1)c1nn(cc1C=C1C(=O)N(CCc2ccc(c(c2)OC)OC)C(=O)C(=C1C)C#N)c1ccccc1
InChI=1SC35H32N4O5c154428141225(131528)3326(2239(3733)2797681027)202923(2)30(2136)35(41)38(34(29)40)181724111631(423)32(1924)434h616192022H51718H214H3b2920
MFCD06647961
ZINC000097946819
ZINC97946819
Check stock
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Check stock on Vitas-MAvailable files
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