Vitas-M small molecule compound
ethyl 2-amino-4-{5-[(3-bromophenoxy)methyl]furan-2-yl}-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carboxylate
Catalog ID
STK960952
SMILES CCOC(=O)C1=C(N)OC2=C(C1c1ccc(o1)COc1cccc(c1)Br)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 C23H22BrNO6 MW 488.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22BrNO6/c1-2-28-23(27)21-20(19-16(26)7-4-8-17(19)31-22(21)25)18-10-9-15(30-18)12-29-14-6-3-5-13(24)11-14/h3,5-6,9-11,20H,2,4,7-8,12,25H2,1H3InChIKey
AVCZLEGZCSXEAH-UHFFFAOYSA-NSynonyms
677778-94-8677778948
CCOC(=O)C1=C(OC2=C(C1C3=CC=C(O3)COC4=CC(=CC=C4)Br)C(=O)CCC2)N
ethyl2amino4(5((3bromophenoxy)methyl)furan2yl)5oxo4678tetrahydrochromene3carboxylate
ethyl2amino4(5((3bromophenoxy)methyl)furan2yl)5oxo5678tetrahydro4Hchromene3carboxylate
InChI=1SC23H22BrNO6c122823(27)2120(1916(26)74817(19)3122(21)25)1810915(3018)12291463513(24)1114h35691120H24781225H21H3
MFCD02243582
ZINC000002769388
ZINC000002769389
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