Vitas-M small molecule compound
(5Z)-5-{[(4-hydroxy-2-methylphenyl)amino]methylidene}-4-methyl-2,6-dioxo-1-(tetrahydrofuran-2-ylmethyl)-1,2,5,6-tetrahydropyridine-3-carbonitrile
Catalog ID
STL226700
SMILES N#CC1=C(C)/C(=C/Nc2ccc(cc2C)O)/C(=O)N(C1=O)CC1CCCO1
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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 C20H21N3O4 MW 367.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N3O4/c1-12-8-14(24)5-6-18(12)22-10-17-13(2)16(9-21)19(25)23(20(17)26)11-15-4-3-7-27-15/h5-6,8,10,15,22,24H,3-4,7,11H2,1-2H3/b17-10-InChIKey
LWJLAUXOSSGRJP-YVLHZVERSA-NSynonyms
(5Z)5(((4hydroxy2methylphenyl)amino)methylidene)4methyl26dioxo1(tetrahydrofuran2ylmethyl)1256tetrahydropyridine3carbonitrile
(5Z)5((4hydroxy2methylanilino)methylidene)4methyl26dioxo1(oxolan2ylmethyl)pyridine3carbonitrile
(Z)5(((4hydroxy2methylphenyl)amino)methylene)4methyl26dioxo1((tetrahydrofuran2yl)methyl)1256tetrahydropyridine3carbonitrile
CC1=C(C=CC(=C1)O)NC=C2C(=C(C(=O)N(C2=O)CC3CCCO3)C#N)C
InChI=1SC20H21N3O4c112814(24)5618(12)22101713(2)16(921)19(25)23(20(17)26)11154372715h56810152224H34711H212H3b1710
MFCD08749297
N#CC1=C(C)C(=CNc2ccc(cc2C)O)C(=O)N(C1=O)CC1CCCO1
ZINC000009344510
ZINC000009344512
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