Vitas-M small molecule compound

N-(2-{6-[(Z)-(2-hydroxy-4,6-dioxo-1,6-dihydropyrimidin-5(4H)-ylidene)methyl]-7-methoxy-1,3-benzodioxol-5-yl}ethyl)-N-methylbenzamide

Catalog ID
STL513725
SMILES COc1c(/C=C\2/C(=O)NC(=NC2=O)O)c(CCN(C(=O)c2ccccc2)C)cc2c1OCO2

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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 C23H21N3O7 MW 451.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21N3O7/c1-26(22(29)13-6-4-3-5-7-13)9-8-14-10-17-19(33-12-32-17)18(31-2)15(14)11-16-20(27)24-23(30)25-21(16)28/h3-7,10-11H,8-9,12H2,1-2H3,(H2,24,25,27,28,30)
InChIKey
PVSWCIQNCLYJJV-UHFFFAOYSA-N
Synonyms
858763-41-4
~(N)(2(7methoxy6((246trioxo13diazinan5ylidene)methyl)13benzodioxol5yl)ethyl)~(N)methylbenzamide
1769639
858763414
InChI=1SC23H21N3O7c126(22(29)136435713)9814101719(33123217)18(312)15(14)111620(27)2423(30)2521(16)28h371011H8912H212H3(H22425272830)
MFCD03266456
N(2(6((Z)(2hydroxy46dioxo16dihydropyrimidin5(4H)ylidene)methyl)7methoxy13benzodioxol5yl)ethyl)Nmethylbenzamide
N(2(7METHOXY6((246TRIOXO13DIAZINAN5YLIDENE)METHYL)13BENZODIOXOL5YL)ETHYL)NMETHYLBENZAMIDE
ZINC000008994657
ZINC8994657

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Available files

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