Vitas-M small molecule compound
2-amino-1-(4-chlorophenyl)-5-oxo-4-(pentafluorophenyl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Catalog ID
STK959084
SMILES N#CC1=C(N)N(c2ccc(cc2)Cl)C2=C(C1c1c(F)c(F)c(c(c1F)F)F)C(=O)CCC2
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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 C22H13ClF5N3O MW 465.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H13ClF5N3O/c23-9-4-6-10(7-5-9)31-12-2-1-3-13(32)15(12)14(11(8-29)22(31)30)16-17(24)19(26)21(28)20(27)18(16)25/h4-7,14H,1-3,30H2InChIKey
LRFBOJZLPLUVKE-UHFFFAOYSA-NSynonyms
2amino1(4chlorophenyl)5oxo4(23456pentafluorophenyl)4678tetrahydroquinoline3carbonitrile
2amino1(4chlorophenyl)5oxo4(pentafluorophenyl)145678hexahydroquinoline3carbonitrile
C1CC2=C(C(C(=C(N2C3=CC=C(C=C3)Cl)N)C#N)C4=C(C(=C(C(=C4F)F)F)F)F)C(=O)C1
InChI=1SC22H13ClF5N3Oc2394610(759)311221313(32)15(12)14(11(829)22(31)30)1617(24)19(26)21(28)20(27)18(16)25h4714H1330H2
MFCD02242968
ZINC000002753920
ZINC000002753921
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