Vitas-M small molecule compound
2'-(4-chlorophenyl)-5'-methyl-3-(pyridin-2-yl)-8-(trifluoromethyl)-2,3,4,4a-tetrahydro-1H,6H-spiro[pyrazino[1,2-a]quinoline-5,4'-pyrazol]-3'(2'H)-one
Catalog ID
STL437399
SMILES Clc1ccc(cc1)N1N=C(C2(C1=O)Cc1cc(ccc1N1C2CN(CC1)c1ccccn1)C(F)(F)F)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 C27H23ClF3N5O MW 525.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H23ClF3N5O/c1-17-26(25(37)36(33-17)21-8-6-20(28)7-9-21)15-18-14-19(27(29,30)31)5-10-22(18)35-13-12-34(16-23(26)35)24-4-2-3-11-32-24/h2-11,14,23H,12-13,15-16H2,1H3InChIKey
PYLVCAIEJWIMAF-UHFFFAOYSA-NSynonyms
2(4chlorophenyl)5methyl3(pyridin2yl)8(trifluoromethyl)2344atetrahydro1H6Hspiro(pyrazino(12a)quinoline54pyrazol)3(2H)one
2(4chlorophenyl)5methyl3pyridin2yl8(trifluoromethyl)spiro(244a6tetrahydro1Hpyrazino(12a)quinoline54pyrazole)3one
CC1=NN(C(=O)C12CC3=C(C=CC(=C3)C(F)(F)F)N4C2CN(CC4)C5=CC=CC=N5)C6=CC=C(C=C6)Cl
InChI=1SC27H23ClF3N5Oc11726(25(37)36(3317)218620(28)7921)15181419(27(2930)31)51022(18)35131234(1623(26)35)24423113224h2111423H12131516H21H3
MFCD09992141
ZINC000101391702
ZINC000248032855
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