Vitas-M small molecule compound
methyl 2-{[(Z)-(1-butyl-5-cyano-4-methyl-2,6-dioxo-1,6-dihydropyridin-3(2H)-ylidene)methyl]amino}-4,5-dimethoxybenzoate
Catalog ID
STK991716
SMILES CCCCN1C(=O)/C(=C\Nc2cc(OC)c(cc2C(=O)OC)OC)/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 C22H25N3O6 MW 427.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25N3O6/c1-6-7-8-25-20(26)15(11-23)13(2)16(21(25)27)12-24-17-10-19(30-4)18(29-3)9-14(17)22(28)31-5/h9-10,12,24H,6-8H2,1-5H3/b16-12-InChIKey
MPMUAFKQGNYEOS-VBKFSLOCSA-NSynonyms
(Z)methyl2(((1butyl5cyano4methyl26dioxo16dihydropyridin3(2H)ylidene)methyl)amino)45dimethoxybenzoate
CCCCN1C(=O)C(=CNC2=CC(=C(C=C2C(=O)OC)OC)OC)C(=C(C1=O)C#N)C
CCCCN1C(=O)C(=CNc2cc(OC)c(cc2C(=O)OC)OC)C(=C(C1=O)C#N)C
InChI=1SC22H25N3O6c16782520(26)15(1123)13(2)16(21(25)27)1224171019(304)18(293)914(17)22(28)315h9101224H68H215H3b1612
methyl2(((Z)(1butyl5cyano4methyl26dioxo16dihydropyridin3(2H)ylidene)methyl)amino)45dimethoxybenzoate
methyl2(((Z)(1butyl5cyano4methyl26dioxopyridin3ylidene)methyl)amino)45dimethoxybenzoate
MFCD08750356
ZINC000009419374
ZINC09419374
ZINC9419374
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