Vitas-M small molecule compound
2-amino-4-(4-chlorophenyl)-1-[2-chloro-5-(trifluoromethyl)phenyl]-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Catalog ID
STK755765
SMILES N#CC1=C(N)N(C2=C(C1c1ccc(cc1)Cl)C(=O)CCC2)c1cc(ccc1Cl)C(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 C23H16Cl2F3N3O MW 478.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H16Cl2F3N3O/c24-14-7-4-12(5-8-14)20-15(11-29)22(30)31(17-2-1-3-19(32)21(17)20)18-10-13(23(26,27)28)6-9-16(18)25/h4-10,20H,1-3,30H2InChIKey
AHXBYDUEZFTIRG-UHFFFAOYSA-NSynonyms
2amino4(4chlorophenyl)1(2chloro5(trifluoromethyl)phenyl)5oxo145678hexahydroquinoline3carbonitrile
2amino4(4chlorophenyl)1(2chloro5(trifluoromethyl)phenyl)5oxo4678tetrahydroquinoline3carbonitrile
C1CC2=C(C(C(=C(N2C3=C(C=CC(=C3)C(F)(F)F)Cl)N)C#N)C4=CC=C(C=C4)Cl)C(=O)C1
InChI=1SC23H16Cl2F3N3Oc24147412(5814)2015(1129)22(30)31(1721319(32)21(17)20)181013(23(2627)28)6916(18)25h41020H1330H2
MFCD01113616
ZINC000002187797
ZINC000002187798
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