Vitas-M small molecule compound
2-amino-4-(4-fluorophenyl)-7,7-dimethyl-1-(4-nitrophenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Catalog ID
STK755702
SMILES N#CC1=C(N)N(C2=C(C1c1ccc(cc1)F)C(=O)CC(C2)(C)C)c1ccc(cc1)[N+](=O)[O-]
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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 C24H21FN4O3 MW 432.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H21FN4O3/c1-24(2)11-19-22(20(30)12-24)21(14-3-5-15(25)6-4-14)18(13-26)23(27)28(19)16-7-9-17(10-8-16)29(31)32/h3-10,21H,11-12,27H2,1-2H3InChIKey
VVOGXEMVMGVKJZ-UHFFFAOYSA-NSynonyms
311773-58-72amino4(4fluorophenyl)77dimethyl1(4nitrophenyl)5oxo145678hexahydroquinoline3carbonitrile
2AMINO4(4FLUOROPHENYL)77DIMETHYL1(4NITROPHENYL)5OXO68DIHYDRO4HQUINOLINE3CARBONITRILE
311773587
CC1(CC2=C(C(C(=C(N2C3=CC=C(C=C3)(N+)(=O)(O))N)C#N)C4=CC=C(C=C4)F)C(=O)C1)C
InChI=1SC24H21FN4O3c124(2)111922(20(30)1224)21(143515(25)6414)18(1326)23(27)28(19)167917(10816)29(31)32h31021H111227H212H3
MFCD01113541
N#CC1=C(N)N(C2=C(C1c1ccc(cc1)F)C(=O)CC(C2)(C)C)c1ccc(cc1)(N+)(=O)(O)
ZINC000008442821
ZINC000008442822
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