Vitas-M small molecule compound
2-amino-7,7-dimethyl-1-(3-nitrophenyl)-5-oxo-4-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Catalog ID
STK755535
SMILES N#CC1=C(N)N(C2=C(C1c1ccccc1)C(=O)CC(C2)(C)C)c1cccc(c1)[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 C24H22N4O3 MW 414.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22N4O3/c1-24(2)12-19-22(20(29)13-24)21(15-7-4-3-5-8-15)18(14-25)23(26)27(19)16-9-6-10-17(11-16)28(30)31/h3-11,21H,12-13,26H2,1-2H3InChIKey
NTGDSYCMGNZZFS-UHFFFAOYSA-NSynonyms
339336-55-92amino77dimethyl1(3nitrophenyl)5oxo4phenyl145678hexahydroquinoline3carbonitrile
2AMINO77DIMETHYL1(3NITROPHENYL)5OXO4PHENYL68DIHYDRO4HQUINOLINE3CARBONITRILE
339336559
CC1(CC2=C(C(C(=C(N2C3=CC(=CC=C3)(N+)(=O)(O))N)C#N)C4=CC=CC=C4)C(=O)C1)C
InChI=1SC24H22N4O3c124(2)121922(20(29)1324)21(157435815)18(1425)23(26)27(19)16961017(1116)28(30)31h31121H121326H212H3
MFCD00828366
N#CC1=C(N)N(C2=C(C1c1ccccc1)C(=O)CC(C2)(C)C)c1cccc(c1)(N+)(=O)(O)
ZINC000001022609
ZINC000001022610
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