Vitas-M small molecule compound
methyl 4-[3,5-dibromo-4-(prop-2-yn-1-yloxy)phenyl]-2-methyl-5-oxo-4,5-dihydro-1H-indeno[1,2-b]pyridine-3-carboxylate
Catalog ID
STL374268
SMILES C#CCOc1c(Br)cc(cc1Br)C1C(=C(C)NC2=C1C(=O)c1c2cccc1)C(=O)OC
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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 C24H17Br2NO4 MW 543.21 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H17Br2NO4/c1-4-9-31-23-16(25)10-13(11-17(23)26)19-18(24(29)30-3)12(2)27-21-14-7-5-6-8-15(14)22(28)20(19)21/h1,5-8,10-11,19,27H,9H2,2-3H3InChIKey
JKHRVKASYOZLBF-UHFFFAOYSA-NSynonyms
CC1=C(C(C2=C(N1)C3=CC=CC=C3C2=O)C4=CC(=C(C(=C4)Br)OCC#C)Br)C(=O)OC
InChI=1SC24H17Br2NO4c149312316(25)1013(1117(23)26)1918(24(29)303)12(2)272114756815(14)22(28)20(19)21h15810111927H9H223H3
methyl4(35dibromo4(prop2yn1yloxy)phenyl)2methyl5oxo45dihydro1Hindeno(12b)pyridine3carboxylate
METHYL4(35DIBROMO4PROP2YNOXYPHENYL)2METHYL5OXO14DIHYDROINDENO(12B)PYRIDINE3CARBOXYLATE
METHYL4(35DIBROMO4PROP2YNYLOXYPHENYL)2METHYL5OXO14DIHYDROINDENO(32B)PYRIDINE3CARBOXYLATE
MFCD02228814
ZINC000100215715
ZINC000100215718
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