Vitas-M small molecule compound
2-amino-1-(2,6-difluorophenyl)-5-oxo-4-[4-(trifluoromethyl)phenyl]-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Catalog ID
STK768768
SMILES N#CC1=C(N)N(C2=C(C1c1ccc(cc1)C(F)(F)F)C(=O)CCC2)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 C23H16F5N3O MW 445.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H16F5N3O/c24-15-3-1-4-16(25)21(15)31-17-5-2-6-18(32)20(17)19(14(11-29)22(31)30)12-7-9-13(10-8-12)23(26,27)28/h1,3-4,7-10,19H,2,5-6,30H2InChIKey
MVKCBXZINPKDPC-UHFFFAOYSA-NSynonyms
2amino1(26difluorophenyl)5oxo4(4(trifluoromethyl)phenyl)145678hexahydroquinoline3carbonitrile
2amino1(26difluorophenyl)5oxo4(4(trifluoromethyl)phenyl)4678tetrahydroquinoline3carbonitrile
C1CC2=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
InChI=1SC23H16F5N3Oc241531416(25)21(15)311752618(32)20(17)19(14(1129)22(31)30)127913(10812)23(2627)28h13471019H25630H2
MFCD03308009
ZINC000000720245
ZINC000000720246
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