Vitas-M small molecule compound
2-amino-4-(3-chlorophenyl)-1-(2,6-difluorophenyl)-7,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Catalog ID
STK768849
SMILES N#CC1=C(N)N(C2=C(C1c1cccc(c1)Cl)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 C24H20ClF2N3O MW 439.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H20ClF2N3O/c1-24(2)10-18-21(19(31)11-24)20(13-5-3-6-14(25)9-13)15(12-28)23(29)30(18)22-16(26)7-4-8-17(22)27/h3-9,20H,10-11,29H2,1-2H3InChIKey
VTKYHTUHVWMKSC-UHFFFAOYSA-NSynonyms
2amino4(3chlorophenyl)1(26difluorophenyl)77dimethyl5oxo145678hexahydroquinoline3carbonitrile
2AMINO4(3CHLOROPHENYL)1(26DIFLUOROPHENYL)77DIMETHYL5OXO68DIHYDRO4HQUINOLINE3CARBONITRILE
CC1(CC2=C(C(C(=C(N2C3=C(C=CC=C3F)F)N)C#N)C4=CC(=CC=C4)Cl)C(=O)C1)C
InChI=1SC24H20ClF2N3Oc124(2)101821(19(31)1124)20(1353614(25)913)15(1228)23(29)30(18)2216(26)74817(22)27h3920H101129H212H3
MFCD03308357
ZINC000000719771
ZINC000000719772
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