Vitas-M small molecule compound
2-amino-4-{2-[(2,4-dichlorobenzyl)oxy]phenyl}-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile
Catalog ID
STL380566
SMILES N#CC1=C(N)OC2=C(C1c1ccccc1OCc1ccc(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 C25H22Cl2N2O3 MW 469.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22Cl2N2O3/c1-25(2)10-19(30)23-21(11-25)32-24(29)17(12-28)22(23)16-5-3-4-6-20(16)31-13-14-7-8-15(26)9-18(14)27/h3-9,22H,10-11,13,29H2,1-2H3InChIKey
GDFCGOZETSTXRW-UHFFFAOYSA-NSynonyms
2amino4(2((24dichlorobenzyl)oxy)phenyl)77dimethyl5oxo5678tetrahydro4Hchromene3carbonitrile
2AMINO4(2((24DICHLOROPHENYL)METHOXY)PHENYL)77DIMETHYL5OXO68DIHYDRO4HCHROMENE3CARBONITRILE
CC1(CC2=C(C(C(=C(O2)N)C#N)C3=CC=CC=C3OCC4=C(C=C(C=C4)Cl)Cl)C(=O)C1)C
InChI=1SC25H22Cl2N2O3c125(2)1019(30)2321(1125)3224(29)17(1228)22(23)16534620(16)3113147815(26)918(14)27h3922H10111329H212H3
MFCD05816050
ZINC000001128482
ZINC000001128484
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