Vitas-M small molecule compound
(5Z)-5-(3,4-dimethoxybenzylidene)-4-methyl-2,6-dioxo-1-(tetrahydrofuran-2-ylmethyl)-1,2,5,6-tetrahydropyridine-3-carbonitrile
Catalog ID
STK908821
SMILES N#CC1=C(C)/C(=C/c2ccc(c(c2)OC)OC)/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 C21H22N2O5 MW 382.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N2O5/c1-13-16(9-14-6-7-18(26-2)19(10-14)27-3)20(24)23(21(25)17(13)11-22)12-15-5-4-8-28-15/h6-7,9-10,15H,4-5,8,12H2,1-3H3/b16-9-InChIKey
XIJRUOHFMXNEMO-SXGWCWSVSA-NSynonyms
(5Z)5((34dimethoxyphenyl)methylidene)4methyl26dioxo1(oxolan2ylmethyl)pyridine3carbonitrile
(5Z)5(34dimethoxybenzylidene)4methyl26dioxo1(tetrahydrofuran2ylmethyl)1256tetrahydropyridine3carbonitrile
CC1=C(C(=O)N(C(=O)C1=CC2=CC(=C(C=C2)OC)OC)CC3CCCO3)C#N
InChI=1SC21H22N2O5c11316(9146718(262)19(1014)273)20(24)23(21(25)17(13)1122)12155482815h6791015H45812H213H3b169
MFCD06648109
N#CC1=C(C)C(=Cc2ccc(c(c2)OC)OC)C(=O)N(C1=O)CC1CCCO1
ZINC000016806565
ZINC000016806567
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