Vitas-M small molecule compound
1-(5-bromopyridin-2-yl)-5-oxo-2-(1H-pyrrol-1-yl)-4-[3-(trifluoromethyl)phenyl]-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Catalog ID
STK686792
SMILES N#CC1=C(n2cccc2)N(C2=C(C1c1cccc(c1)C(F)(F)F)C(=O)CCC2)c1ccc(cn1)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 C26H18BrF3N4O MW 539.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H18BrF3N4O/c27-18-9-10-22(32-15-18)34-20-7-4-8-21(35)24(20)23(16-5-3-6-17(13-16)26(28,29)30)19(14-31)25(34)33-11-1-2-12-33/h1-3,5-6,9-13,15,23H,4,7-8H2InChIKey
UAKYCIZZXJONAD-UHFFFAOYSA-NSynonyms
1(5bromopyridin2yl)5oxo2(1Hpyrrol1yl)4(3(trifluoromethyl)phenyl)145678hexahydroquinoline3carbonitrile
1(5bromopyridin2yl)5oxo2pyrrol1yl4(3(trifluoromethyl)phenyl)4678tetrahydroquinoline3carbonitrile
C1CC2=C(C(C(=C(N2C3=NC=C(C=C3)Br)N4C=CC=C4)C#N)C5=CC(=CC=C5)C(F)(F)F)C(=O)C1
InChI=1SC26H18BrF3N4Oc271891022(321518)342074821(35)24(20)23(1653617(1316)26(2829)30)19(1431)25(34)3311121233h13569131523H478H2
MFCD06017594
ZINC000098008081
ZINC000098008082
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