Vitas-M small molecule compound
2-amino-4-(1,3-benzodioxol-5-yl)-1-(dimethylamino)-7,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Catalog ID
STK773167
SMILES N#CC1=C(N)N(N(C)C)C2=C(C1c1ccc3c(c1)OCO3)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 C21H24N4O3 MW 380.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N4O3/c1-21(2)8-14-19(15(26)9-21)18(13(10-22)20(23)25(14)24(3)4)12-5-6-16-17(7-12)28-11-27-16/h5-7,18H,8-9,11,23H2,1-4H3InChIKey
BQSYYKXXZAPHMU-UHFFFAOYSA-NSynonyms
2amino4(13benzodioxol5yl)1(dimethylamino)77dimethyl5oxo145678hexahydroquinoline3carbonitrile
2AMINO4(13BENZODIOXOL5YL)1(DIMETHYLAMINO)77DIMETHYL5OXO68DIHYDRO4HQUINOLINE3CARBONITRILE
CC1(CC2=C(C(C(=C(N2N(C)C)N)C#N)C3=CC4=C(C=C3)OCO4)C(=O)C1)C
InChI=1SC21H24N4O3c121(2)81419(15(26)921)18(13(1022)20(23)25(14)24(3)4)12561617(712)28112716h5718H891123H214H3
MFCD03821358
ZINC000001080044
ZINC000001080045
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