Vitas-M small molecule compound
2-amino-7,7-dimethyl-1-(4-nitrophenyl)-5-oxo-4-(pyridin-3-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Catalog ID
STK754788
SMILES N#CC1=C(N)N(C2=C(C1c1cccnc1)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 C23H21N5O3 MW 415.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21N5O3/c1-23(2)10-18-21(19(29)11-23)20(14-4-3-9-26-13-14)17(12-24)22(25)27(18)15-5-7-16(8-6-15)28(30)31/h3-9,13,20H,10-11,25H2,1-2H3InChIKey
XNGMUZCVRITRBZ-UHFFFAOYSA-NSynonyms
311323-40-72amino77dimethyl1(4nitrophenyl)5oxo4(pyridin3yl)145678hexahydroquinoline3carbonitrile
2AMINO77DIMETHYL1(4NITROPHENYL)5OXO4PYRIDIN3YL68DIHYDRO4HQUINOLINE3CARBONITRILE
311323407
CC1(CC2=C(C(C(=C(N2C3=CC=C(C=C3)(N+)(=O)(O))N)C#N)C4=CN=CC=C4)C(=O)C1)C
InChI=1SC23H21N5O3c123(2)101821(19(29)1123)20(14439261314)17(1224)22(25)27(18)155716(8615)28(30)31h391320H101125H212H3
MFCD00826641
N#CC1=C(N)N(C2=C(C1c1cccnc1)C(=O)CC(C2)(C)C)c1ccc(cc1)(N+)(=O)(O)
ZINC000004181149
ZINC000004181150
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