Vitas-M small molecule compound
2-amino-4-[1-(2,6-dichlorobenzyl)-3-phenyl-1H-pyrazol-4-yl]-5-oxo-1-[2-(trifluoromethyl)phenyl]-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Catalog ID
STK316527
SMILES N#CC1=C(N)N(C2=C(C1c1cn(nc1c1ccccc1)Cc1c(Cl)cccc1Cl)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 C33H24Cl2F3N5O MW 634.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H24Cl2F3N5O/c34-24-11-6-12-25(35)21(24)17-42-18-22(31(41-42)19-8-2-1-3-9-19)29-20(16-39)32(40)43(27-14-7-15-28(44)30(27)29)26-13-5-4-10-23(26)33(36,37)38/h1-6,8-13,18,29H,7,14-15,17,40H2InChIKey
ONKJQTSRFFLUNZ-UHFFFAOYSA-NSynonyms
514856-20-32amino4(1((26dichlorophenyl)methyl)3phenylpyrazol4yl)5oxo1(2(trifluoromethyl)phenyl)4678tetrahydroquinoline3carbonitrile
2amino4(1(26dichlorobenzyl)3phenyl1Hpyrazol4yl)5oxo1(2(trifluoromethyl)phenyl)145678hexahydroquinoline3carbonitrile
514856203
C1CC2=C(C(C(=C(N2C3=CC=CC=C3C(F)(F)F)N)C#N)C4=CN(N=C4C5=CC=CC=C5)CC6=C(C=CC=C6Cl)Cl)C(=O)C1
InChI=1SC33H24Cl2F3N5Oc34241161225(35)21(24)17421822(31(4142)198213919)2920(1639)32(40)43(271471528(44)30(27)29)2613541023(26)33(3637)38h168131829H714151740H2
MFCD03757951
ZINC000008456163
ZINC000008456164
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