Vitas-M small molecule compound
10a-[(E)-2-{3-methoxy-4-[(2-methylprop-2-en-1-yl)oxy]phenyl}ethenyl]-8,10,10-trimethyl-3,4,10,10a-tetrahydropyrimido[1,2-a]indol-2(1H)-one
Catalog ID
STL533562
SMILES COc1cc(/C=C/C23NC(=O)CCN2c2c(C3(C)C)cc(cc2)C)ccc1OCC(=C)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 C27H32N2O3 MW 432.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H32N2O3/c1-18(2)17-32-23-10-8-20(16-24(23)31-6)11-13-27-26(4,5)21-15-19(3)7-9-22(21)29(27)14-12-25(30)28-27/h7-11,13,15-16H,1,12,14,17H2,2-6H3,(H,28,30)/b13-11+InChIKey
FTQXATWVZGELIV-ACCUITESSA-NSynonyms
(E)10a(3methoxy4((2methylallyl)oxy)styryl)81010trimethyl341010atetrahydropyrimido(12a)indol2(1H)one
10~(a)((~(E))2(3methoxy4(2methylprop2enoxy)phenyl)ethenyl)81010trimethyl34dihydro1~(H)pyrimido(12a)indol2one
10a((E)2(3methoxy4((2methylprop2en1yl)oxy)phenyl)ethenyl)81010trimethyl341010atetrahydropyrimido(12a)indol2(1H)one
6216596
COc1cc(C=CC23NC(=O)CCN2c2c(C3(C)C)cc(cc2)C)ccc1OCC(=C)C
InChI=1SC27H32N2O3c118(2)17322310820(1624(23)316)11132726(45)211519(3)7922(21)29(27)141225(30)2827h711131516H1121417H226H3(H2830)b1311+
MFCD04191038
ZINC000002128690
ZINC000008918622
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