Vitas-M small molecule compound
methyl 4-{4-[(4-bromobenzyl)oxy]phenyl}-2-methyl-5-oxo-4,5-dihydro-1H-indeno[1,2-b]pyridine-3-carboxylate
Catalog ID
STL374218
SMILES COC(=O)C1=C(C)NC2=C(C1c1ccc(cc1)OCc1ccc(cc1)Br)C(=O)c1c2cccc1
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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 C28H22BrNO4 MW 516.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H22BrNO4/c1-16-23(28(32)33-2)24(25-26(30-16)21-5-3-4-6-22(21)27(25)31)18-9-13-20(14-10-18)34-15-17-7-11-19(29)12-8-17/h3-14,24,30H,15H2,1-2H3InChIKey
ITIBYLFQDOXKNL-UHFFFAOYSA-NSynonyms
CC1=C(C(C2=C(N1)C3=CC=CC=C3C2=O)C4=CC=C(C=C4)OCC5=CC=C(C=C5)Br)C(=O)OC
InChI=1SC28H22BrNO4c11623(28(32)332)24(2526(3016)21534622(21)27(25)31)1891320(141018)34151771119(29)12817h3142430H15H212H3
methyl4(4((4bromobenzyl)oxy)phenyl)2methyl5oxo45dihydro1Hindeno(12b)pyridine3carboxylate
METHYL4(4((4BROMOPHENYL)METHOXY)PHENYL)2METHYL5OXO14DIHYDROINDENO(12B)PYRIDINE3CARBOXYLATE
METHYL4(4((4BROMOPHENYL)METHOXY)PHENYL)2METHYL5OXO14DIHYDROINDENO(32B)PYRIDINE3CARBOXYLATE
MFCD02228771
ZINC000019804589
ZINC000019804591
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