Vitas-M small molecule compound
methyl 2-amino-4-{5-bromo-2-[(3,4-dichlorobenzyl)oxy]phenyl}-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carboxylate
Catalog ID
STL379744
SMILES COC(=O)C1=C(N)OC2=C(C1c1cc(Br)ccc1OCc1ccc(c(c1)Cl)Cl)C(=O)CCC2
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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 C24H20BrCl2NO5 MW 553.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H20BrCl2NO5/c1-31-24(30)22-20(21-17(29)3-2-4-19(21)33-23(22)28)14-10-13(25)6-8-18(14)32-11-12-5-7-15(26)16(27)9-12/h5-10,20H,2-4,11,28H2,1H3InChIKey
GWJUDITYULYGCY-UHFFFAOYSA-NSynonyms
COC(=O)C1=C(OC2=C(C1C3=C(C=CC(=C3)Br)OCC4=CC(=C(C=C4)Cl)Cl)C(=O)CCC2)N
InChI=1SC24H20BrCl2NO5c13124(30)2220(2117(29)32419(21)3323(22)28)141013(25)6818(14)3211125715(26)16(27)912h51020H241128H21H3
methyl2amino4(5bromo2((34dichlorobenzyl)oxy)phenyl)5oxo5678tetrahydro4Hchromene3carboxylate
methyl2amino4(5bromo2((34dichlorophenyl)methoxy)phenyl)5oxo4678tetrahydrochromene3carboxylate
MFCD06124630
ZINC000100337676
ZINC000100337680
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