Vitas-M small molecule compound
2-amino-4-(2-chloro-6-fluorophenyl)-7,7-dimethyl-1-(3-nitrophenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Catalog ID
STK570358
SMILES N#CC1=C(N)N(c2cccc(c2)[N+](=O)[O-])C2=C(C1c1c(F)cccc1Cl)C(=O)CC(C2)(C)C
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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 C24H20ClFN4O3 MW 466.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H20ClFN4O3/c1-24(2)10-18-22(19(31)11-24)20(21-16(25)7-4-8-17(21)26)15(12-27)23(28)29(18)13-5-3-6-14(9-13)30(32)33/h3-9,20H,10-11,28H2,1-2H3InChIKey
OBFSHDURNPKMBW-UHFFFAOYSA-NSynonyms
714941-16-92amino4(2chloro6fluorophenyl)77dimethyl1(3nitrophenyl)5oxo145678hexahydroquinoline3carbonitrile
2AMINO4(2CHLORO6FLUOROPHENYL)77DIMETHYL1(3NITROPHENYL)5OXO68DIHYDRO4HQUINOLINE3CARBONITRILE
714941169
CC1(CC2=C(C(C(=C(N2C3=CC(=CC=C3)(N+)(=O)(O))N)C#N)C4=C(C=CC=C4Cl)F)C(=O)C1)C
InChI=1SC24H20ClFN4O3c124(2)101822(19(31)1124)20(2116(25)74817(21)26)15(1227)23(28)29(18)1353614(913)30(32)33h3920H101128H212H3
MFCD03675822
N#CC1=C(N)N(c2cccc(c2)(N+)(=O)(O))C2=C(C1c1c(F)cccc1Cl)C(=O)CC(C2)(C)C
ZINC000009009303
ZINC000009009304
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