Vitas-M small molecule compound
(5Z)-5-[(1,3-benzodioxol-5-ylamino)methylidene]-4-methyl-2,6-dioxo-1-[3-(2-oxopyrrolidin-1-yl)propyl]-1,2,5,6-tetrahydropyridine-3-carbonitrile
Catalog ID
STK719244
SMILES N#CC1=C(C)/C(=C/Nc2ccc3c(c2)OCO3)/C(=O)N(C1=O)CCCN1CCCC1=O
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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 C22H22N4O5 MW 422.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N4O5/c1-14-16(11-23)21(28)26(9-3-8-25-7-2-4-20(25)27)22(29)17(14)12-24-15-5-6-18-19(10-15)31-13-30-18/h5-6,10,12,24H,2-4,7-9,13H2,1H3/b17-12-InChIKey
YDBJSOPWQVOUCJ-ATVHPVEESA-NSynonyms
(5Z)5((13benzodioxol5ylamino)methylidene)4methyl26dioxo1(3(2oxopyrrolidin1yl)propyl)1256tetrahydropyridine3carbonitrile
(5Z)5((13benzodioxol5ylamino)methylidene)4methyl26dioxo1(3(2oxopyrrolidin1yl)propyl)pyridine3carbonitrile
(Z)5((benzo(d)(13)dioxol5ylamino)methylene)4methyl26dioxo1(3(2oxopyrrolidin1yl)propyl)1256tetrahydropyridine3carbonitrile
CC1=C(C(=O)N(C(=O)C1=CNC2=CC3=C(C=C2)OCO3)CCCN4CCCC4=O)C#N
InChI=1SC22H22N4O5c11416(1123)21(28)26(9382572420(25)27)22(29)17(14)122415561819(1015)31133018h56101224H247913H21H3b1712
MFCD09846882
N#CC1=C(C)C(=CNc2ccc3c(c2)OCO3)C(=O)N(C1=O)CCCN1CCCC1=O
ZINC000009423554
ZINC09423554
ZINC9423554
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