Vitas-M small molecule compound
2-{[(3,4-dimethylphenyl)amino]methylidene}-5,5-dimethylcyclohexane-1,3-dione
Catalog ID
STK095219
SMILES O=C1CC(C)(C)CC(=O)C1=CNc1ccc(c(c1)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 C17H21NO2 MW 271.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H21NO2/c1-11-5-6-13(7-12(11)2)18-10-14-15(19)8-17(3,4)9-16(14)20/h5-7,10,18H,8-9H2,1-4H3InChIKey
HLJGUOQQOJEFAK-UHFFFAOYSA-NSynonyms
2(((34DIMETHYLPHENYL)AMINO)METHYLIDENE)55DIMETHYLCYCLOHEXANE13DIONE
2((34DIMETHYLANILINO)METHYLIDENE)55DIMETHYLCYCLOHEXANE13DIONE
CC1=C(C=C(C=C1)NC=C2C(=O)CC(CC2=O)(C)C)C
InChI=1SC17H21NO2c1115613(712(11)2)18101415(19)817(34)916(14)20h571018H89H214H3
MFCD00298571
O=C1CC(C)(C)CC(=O)C1=CNc1ccc(c(c1)C)C
STK095219
ZINC000000260244
ZINC00260244
ZINC260244
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