Vitas-M small molecule compound
11-imino-2-(4-methylphenyl)hexahydro-2H-9a,4-(epoxymethano)cyclohepta[b]pyran-3,3,4-tricarbonitrile
Catalog ID
STK988652
SMILES N#CC12C(=N)OC3(C1CCCCC3)OC(C2(C#N)C#N)c1ccc(cc1)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 C21H20N4O2 MW 360.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N4O2/c1-14-6-8-15(9-7-14)17-19(11-22,12-23)20(13-24)16-5-3-2-4-10-21(16,26-17)27-18(20)25/h6-9,16-17,25H,2-5,10H2,1H3/b25-18+InChIKey
PKDKTLASUVQSFI-XIEYBQDHSA-NSynonyms
1164552-09-31164552093
11imino2(4methylphenyl)hexahydro2H9a4(epoxymethano)cyclohepta(b)pyran334tricarbonitrile
11imino2(ptolyl)hexahydro2H9a4(epoxymethano)cyclohepta(b)pyran334(4H)tricarbonitrile
MFCD03686389
ZINC000169294970
ZINC000245311641
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