Vitas-M small molecule compound
2-amino-4-(2,4-dichlorophenyl)-7,7-dimethyl-1-(3-nitrophenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Catalog ID
STL055057
SMILES N#CC1=C(N)N(c2cccc(c2)[N+](=O)[O-])C2=C(C1c1ccc(cc1Cl)Cl)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 C24H20Cl2N4O3 MW 483.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H20Cl2N4O3/c1-24(2)10-19-22(20(31)11-24)21(16-7-6-13(25)8-18(16)26)17(12-27)23(28)29(19)14-4-3-5-15(9-14)30(32)33/h3-9,21H,10-11,28H2,1-2H3InChIKey
ICVKHTJLCGGISX-UHFFFAOYSA-NSynonyms
713094-97-42amino4(24dichlorophenyl)77dimethyl1(3nitrophenyl)5oxo145678hexahydroquinoline3carbonitrile
2AMINO4(24DICHLOROPHENYL)77DIMETHYL1(3NITROPHENYL)5OXO68DIHYDRO4HQUINOLINE3CARBONITRILE
713094974
CC1(CC2=C(C(C(=C(N2C3=CC(=CC=C3)(N+)(=O)(O))N)C#N)C4=C(C=C(C=C4)Cl)Cl)C(=O)C1)C
InChI=1SC24H20Cl2N4O3c124(2)101922(20(31)1124)21(167613(25)818(16)26)17(1227)23(28)29(19)1443515(914)30(32)33h3921H101128H212H3
MFCD03679842
N#CC1=C(N)N(c2cccc(c2)(N+)(=O)(O))C2=C(C1c1ccc(cc1Cl)Cl)C(=O)CC(C2)(C)C
ZINC000009244841
ZINC000009244842
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