Vitas-M small molecule compound
3-butyl-5-imino-1-methyl-7-phenyl-2,6-dioxabicyclo[2.2.2]octane-4,8,8-tricarbonitrile
Catalog ID
STK550760
SMILES CCCCC1OC2(C)OC(=N)C1(C#N)C(C2c1ccccc1)(C#N)C#N
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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 C20H20N4O2 MW 348.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20N4O2/c1-3-4-10-15-20(13-23)17(24)26-18(2,25-15)16(19(20,11-21)12-22)14-8-6-5-7-9-14/h5-9,15-16,24H,3-4,10H2,1-2H3/b24-17-InChIKey
SCYCBLSAQGJWEG-ULJHMMPZSA-NSynonyms
1005041-86-01005041860
3butyl5imino1methyl7phenyl26dioxabicyclo(222)octane488tricarbonitrile
MFCD01951135
ZINC000102707875
ZINC000137931496
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