Vitas-M small molecule compound
8-bromo-10a-[(E)-2-(4-fluorophenyl)ethenyl]-10,10-dimethyl-3,4,10,10a-tetrahydropyrimido[1,2-a]indol-2(1H)-one
Catalog ID
STK530912
SMILES O=C1CCN2C(N1)(/C=C/c1ccc(cc1)F)C(C)(C)c1c2ccc(c1)Br
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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 C21H20BrFN2O MW 415.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20BrFN2O/c1-20(2)17-13-15(22)5-8-18(17)25-12-10-19(26)24-21(20,25)11-9-14-3-6-16(23)7-4-14/h3-9,11,13H,10,12H2,1-2H3,(H,24,26)/b11-9+InChIKey
YCEPCDDQXQSTFN-PKNBQFBNSA-NSynonyms
(E)8bromo10a(4fluorostyryl)1010dimethyl341010atetrahydropyrimido(12a)indol2(1H)one
8bromo10a((E)2(4fluorophenyl)ethenyl)1010dimethyl341010atetrahydropyrimido(12a)indol2(1H)one
8bromo10a((E)2(4fluorophenyl)ethenyl)1010dimethyl34dihydro1Hpyrimido(12a)indol2one
CC1(C2=C(C=CC(=C2)Br)N3C1(NC(=O)CC3)C=CC4=CC=C(C=C4)F)C
InChI=1SC21H20BrFN2Oc120(2)171315(22)5818(17)25121019(26)2421(2025)119143616(23)7414h391113H1012H212H3(H2426)b119+
MFCD01547596
O=C1CCN2C(N1)(C=Cc1ccc(cc1)F)C(C)(C)c1c2ccc(c1)Br
ZINC000002298490
ZINC000004811849
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