Vitas-M small molecule compound
5-oxo-4-(pyridin-3-yl)-2-(1H-pyrrol-1-yl)-1-[2-(trifluoromethyl)phenyl]-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Catalog ID
STK781172
SMILES N#CC1=C(n2cccc2)N(C2=C(C1c1cccnc1)C(=O)CCC2)c1ccccc1C(F)(F)F
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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 C26H19F3N4O MW 460.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H19F3N4O/c27-26(28,29)19-8-1-2-9-20(19)33-21-10-5-11-22(34)24(21)23(17-7-6-12-31-16-17)18(15-30)25(33)32-13-3-4-14-32/h1-4,6-9,12-14,16,23H,5,10-11H2InChIKey
PONLEEQVYKSFSD-UHFFFAOYSA-NSynonyms
5oxo4(pyridin3yl)2(1Hpyrrol1yl)1(2(trifluoromethyl)phenyl)145678hexahydroquinoline3carbonitrile
5oxo4pyridin3yl2pyrrol1yl1(2(trifluoromethyl)phenyl)4678tetrahydroquinoline3carbonitrile
C1CC2=C(C(C(=C(N2C3=CC=CC=C3C(F)(F)F)N4C=CC=C4)C#N)C5=CN=CC=C5)C(=O)C1
InChI=1SC26H19F3N4Oc2726(2829)19812920(19)33211051122(34)24(21)23(177612311617)18(1530)25(33)3213341432h146912141623H51011H2
MFCD06014439
ZINC000001432896
ZINC000001432897
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