Vitas-M small molecule compound
3-(3-chlorophenyl)-5'-methyl-2'-phenyl-8-(trifluoromethyl)-2,3,4,4a-tetrahydro-1H,6H-spiro[pyrazino[1,2-a]quinoline-5,4'-pyrazol]-3'(2'H)-one
Catalog ID
STL437343
SMILES Clc1cccc(c1)N1CCN2C(C1)C1(Cc3c2ccc(c3)C(F)(F)F)C(=NN(C1=O)c1ccccc1)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 C28H24ClF3N4O MW 524.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H24ClF3N4O/c1-18-27(26(37)36(33-18)22-7-3-2-4-8-22)16-19-14-20(28(30,31)32)10-11-24(19)35-13-12-34(17-25(27)35)23-9-5-6-21(29)15-23/h2-11,14-15,25H,12-13,16-17H2,1H3InChIKey
ABSAGNKPEYTWEN-UHFFFAOYSA-NSynonyms
3(3chlorophenyl)5methyl2phenyl8(trifluoromethyl)2344atetrahydro1H6Hspiro(pyrazino(12a)quinoline54pyrazol)3(2H)one
3(3chlorophenyl)5methyl2phenyl8(trifluoromethyl)spiro(244a6tetrahydro1Hpyrazino(12a)quinoline54pyrazole)3one
CC1=NN(C(=O)C12CC3=C(C=CC(=C3)C(F)(F)F)N4C2CN(CC4)C5=CC(=CC=C5)Cl)C6=CC=CC=C6
InChI=1SC28H24ClF3N4Oc11827(26(37)36(3318)227324822)16191420(28(3031)32)101124(19)35131234(1725(27)35)2395621(29)1523h211141525H12131617H21H3
MFCD09992086
ZINC000101391862
ZINC000247989884
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