Vitas-M small molecule compound
2-amino-4-{5-bromo-2-[(4-chlorobenzyl)oxy]phenyl}-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile
Catalog ID
STL169550
SMILES N#CC1=C(N)OC2=C(C1c1cc(Br)ccc1OCc1ccc(cc1)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 C25H22BrClN2O3 MW 513.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22BrClN2O3/c1-25(2)10-19(30)23-21(11-25)32-24(29)18(12-28)22(23)17-9-15(26)5-8-20(17)31-13-14-3-6-16(27)7-4-14/h3-9,22H,10-11,13,29H2,1-2H3InChIKey
VFBOSPYJNTYQJM-UHFFFAOYSA-NSynonyms
738621-03-92amino4(5bromo2((4chlorobenzyl)oxy)phenyl)77dimethyl5oxo5678tetrahydro4Hchromene3carbonitrile
2AMINO4(5BROMO2((4CHLOROPHENYL)METHOXY)PHENYL)77DIMETHYL5OXO68DIHYDRO4HCHROMENE3CARBONITRILE
738621039
CC1(CC2=C(C(C(=C(O2)N)C#N)C3=C(C=CC(=C3)Br)OCC4=CC=C(C=C4)Cl)C(=O)C1)C
InChI=1SC25H22BrClN2O3c125(2)1019(30)2321(1125)3224(29)18(1228)22(23)17915(26)5820(17)3113143616(27)7414h3922H10111329H212H3
MFCD03883588
ZINC000002743677
ZINC000002743678
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