Vitas-M small molecule compound
8,10,10-trimethyl-10a-{(E)-2-[3-(prop-2-en-1-yloxy)phenyl]ethenyl}-3,4,10,10a-tetrahydropyrimido[1,2-a]indol-2(1H)-one
Catalog ID
STL007206
SMILES C=CCOc1cccc(c1)/C=C/C12NC(=O)CCN1c1c(C2(C)C)cc(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 C25H28N2O2 MW 388.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H28N2O2/c1-5-15-29-20-8-6-7-19(17-20)11-13-25-24(3,4)21-16-18(2)9-10-22(21)27(25)14-12-23(28)26-25/h5-11,13,16-17H,1,12,14-15H2,2-4H3,(H,26,28)/b13-11+InChIKey
OQMWOSDRKYQRQV-ACCUITESSA-NSynonyms
(E)10a(3(allyloxy)styryl)81010trimethyl341010atetrahydropyrimido(12a)indol2(1H)one
81010trimethyl10a((E)2(3(prop2en1yloxy)phenyl)ethenyl)341010atetrahydropyrimido(12a)indol2(1H)one
81010trimethyl10a((E)2(3prop2enoxyphenyl)ethenyl)34dihydro1Hpyrimido(12a)indol2one
C=CCOc1cccc(c1)C=CC12NC(=O)CCN1c1c(C2(C)C)cc(cc1)C
CC1=CC2=C(C=C1)N3CCC(=O)NC3(C2(C)C)C=CC4=CC(=CC=C4)OCC=C
InChI=1SC25H28N2O2c1515292086719(1720)11132524(34)211618(2)91022(21)27(25)141223(28)2625h511131617H1121415H224H3(H2628)b1311+
MFCD06492525
ZINC000002126796
ZINC000004000109
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