Vitas-M small molecule compound
2-amino-1-(2,6-difluorophenyl)-7,7-dimethyl-5-oxo-4-[4-(trifluoromethyl)phenyl]-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Catalog ID
STK768769
SMILES N#CC1=C(N)N(C2=C(C1c1ccc(cc1)C(F)(F)F)C(=O)CC(C2)(C)C)c1c(F)cccc1F
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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 C25H20F5N3O MW 473.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H20F5N3O/c1-24(2)10-18-21(19(34)11-24)20(13-6-8-14(9-7-13)25(28,29)30)15(12-31)23(32)33(18)22-16(26)4-3-5-17(22)27/h3-9,20H,10-11,32H2,1-2H3InChIKey
JGBIPDKSCSWHCD-UHFFFAOYSA-NSynonyms
2amino1(26difluorophenyl)77dimethyl5oxo4(4(trifluoromethyl)phenyl)145678hexahydroquinoline3carbonitrile
2AMINO1(26DIFLUOROPHENYL)77DIMETHYL5OXO4(4(TRIFLUOROMETHYL)PHENYL)68DIHYDRO4HQUINOLINE3CARBONITRILE
CC1(CC2=C(C(C(=C(N2C3=C(C=CC=C3F)F)N)C#N)C4=CC=C(C=C4)C(F)(F)F)C(=O)C1)C
InChI=1SC25H20F5N3Oc124(2)101821(19(34)1124)20(136814(9713)25(2829)30)15(1231)23(32)33(18)2216(26)43517(22)27h3920H101132H212H3
MFCD03308243
ZINC000002192621
ZINC000002192622
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