Vitas-M small molecule compound
2-amino-4-[4-(difluoromethoxy)-3-ethoxyphenyl]-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile
Catalog ID
STK049407
SMILES CCOc1cc(ccc1OC(F)F)C1C(=C(N)OC2=C1C(=O)CC(C2)(C)C)C#N
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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 C21H22F2N2O4 MW 404.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22F2N2O4/c1-4-27-15-7-11(5-6-14(15)29-20(22)23)17-12(10-24)19(25)28-16-9-21(2,3)8-13(26)18(16)17/h5-7,17,20H,4,8-9,25H2,1-3H3InChIKey
DUZQLBOCOPIAOF-UHFFFAOYSA-NSynonyms
2AMINO4(4(DIFLUOROMETHOXY)3ETHOXYPHENYL)77DIMETHYL5OXO4H678TRIHYDROCHROMENE3CARBONITRILE
2amino4(4(difluoromethoxy)3ethoxyphenyl)77dimethyl5oxo5678tetrahydro4Hchromene3carbonitrile
2AMINO4(4(DIFLUOROMETHOXY)3ETHOXYPHENYL)77DIMETHYL5OXO68DIHYDRO4HCHROMENE3CARBONITRILE
CCOC1=C(C=CC(=C1)C2C(=C(OC3=C2C(=O)CC(C3)(C)C)N)C#N)OC(F)F
CCOc1cc(ccc1OC(F)F)C1C(=C(N)OC2=C1C(=O)CC(C2)(C)C)C#N
InChI=1SC21H22F2N2O4c142715711(5614(15)2920(22)23)1712(1024)19(25)2816921(23)813(26)18(16)17h571720H48925H213H3
MFCD02943536
STK049407
ZINC000000706806
ZINC000000706807
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