Vitas-M small molecule compound

methyl 4-(4-bromophenyl)-2-methyl-5-oxo-4,5-dihydro-1H-indeno[1,2-b]pyridine-3-carboxylate

Catalog ID
STK133237
SMILES COC(=O)C1=C(C)NC2=C(C1c1ccc(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 C21H16BrNO3 MW 410.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16BrNO3/c1-11-16(21(25)26-2)17(12-7-9-13(22)10-8-12)18-19(23-11)14-5-3-4-6-15(14)20(18)24/h3-10,17,23H,1-2H3
InChIKey
NCGNAYMICBDXBF-UHFFFAOYSA-N
Synonyms
425614-29-5
425614295
CC1=C(C(C2=C(N1)C3=CC=CC=C3C2=O)C4=CC=C(C=C4)Br)C(=O)OC
InChI=1SC21H16BrNO3c11116(21(25)262)17(127913(22)10812)1819(2311)14534615(14)20(18)24h3101723H12H3
METHYL4(4BROMOPHENYL)2METHYL5OXO14DIHYDROINDENO(12B)PYRIDINE3CARBOXYLATE
METHYL4(4BROMOPHENYL)2METHYL5OXO1H4H5HINDENO(12B)PYRIDINE3CARBOXYLATE
METHYL4(4BROMOPHENYL)2METHYL5OXO45DIHYDRO1HINDENO(12B)PYRIDINE3CARBOXYLATE
MFCD02636042
ZINC000019804571
ZINC000019804573

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.