Vitas-M small molecule compound
5'-methyl-2'-phenyl-3-(pyrimidin-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
STL437345
SMILES CC1=NN(C(=O)C21Cc1cc(ccc1N1C2CN(CC1)c1ncccn1)C(F)(F)F)c1ccccc1
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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 C26H23F3N6O MW 492.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23F3N6O/c1-17-25(23(36)35(32-17)20-6-3-2-4-7-20)15-18-14-19(26(27,28)29)8-9-21(18)34-13-12-33(16-22(25)34)24-30-10-5-11-31-24/h2-11,14,22H,12-13,15-16H2,1H3InChIKey
MLUBNVFXCXFNOG-UHFFFAOYSA-NSynonyms
5methyl2phenyl3(pyrimidin2yl)8(trifluoromethyl)2344atetrahydro1H6Hspiro(pyrazino(12a)quinoline54pyrazol)3(2H)one
5methyl2phenyl3pyrimidin2yl8(trifluoromethyl)spiro(244a6tetrahydro1Hpyrazino(12a)quinoline54pyrazole)3one
CC1=NN(C(=O)C12CC3=C(C=CC(=C3)C(F)(F)F)N4C2CN(CC4)C5=NC=CC=N5)C6=CC=CC=C6
InChI=1SC26H23F3N6Oc11725(23(36)35(3217)206324720)15181419(26(2728)29)8921(18)34131233(1622(25)34)2430105113124h2111422H12131516H21H3
MFCD09992088
ZINC000025184639
ZINC000248022918
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