Vitas-M small molecule compound
2-amino-5-oxo-4-(pentafluorophenyl)-1-[2-(trifluoromethyl)phenyl]-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Catalog ID
STL174533
SMILES N#CC1=C(N)N(C2=C(C1c1c(F)c(F)c(c(c1F)F)F)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 C23H13F8N3O MW 499.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H13F8N3O/c24-17-16(18(25)20(27)21(28)19(17)26)14-9(8-32)22(33)34(12-6-3-7-13(35)15(12)14)11-5-2-1-4-10(11)23(29,30)31/h1-2,4-5,14H,3,6-7,33H2InChIKey
AEVVUYCTNTWBBS-UHFFFAOYSA-NSynonyms
514817-80-22amino5oxo4(23456pentafluorophenyl)1(2(trifluoromethyl)phenyl)4678tetrahydroquinoline3carbonitrile
2amino5oxo4(pentafluorophenyl)1(2(trifluoromethyl)phenyl)145678hexahydroquinoline3carbonitrile
514817802
C1CC2=C(C(C(=C(N2C3=CC=CC=C3C(F)(F)F)N)C#N)C4=C(C(=C(C(=C4F)F)F)F)F)C(=O)C1
InChI=1SC23H13F8N3Oc241716(18(25)20(27)21(28)19(17)26)149(832)22(33)34(1263713(35)15(12)14)11521410(11)23(2930)31h124514H36733H2
MFCD02606112
ZINC000002760126
ZINC000002760127
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