Vitas-M small molecule compound
ethyl (5E)-5-(3-bromobenzylidene)-2-methyl-4-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Catalog ID
STK160297
SMILES CCOC(=O)C1=C(C)N/C(=C/c2cccc(c2)Br)/C1=O
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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 C15H14BrNO3 MW 336.19 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H14BrNO3/c1-3-20-15(19)13-9(2)17-12(14(13)18)8-10-5-4-6-11(16)7-10/h4-8,17H,3H2,1-2H3/b12-8+InChIKey
BTLFOLYMBPNNNA-XYOKQWHBSA-NSynonyms
CCOC(=O)C1=C(C)NC(=Cc2cccc(c2)Br)C1=O
CCOC(=O)C1=C(NC(=CC2=CC(=CC=C2)Br)C1=O)C
ethyl(5E)5((3bromophenyl)methylidene)2methyl4oxo1Hpyrrole3carboxylate
ETHYL(5E)5(3BROMOBENZYLIDENE)2METHYL4OXO45DIHYDRO1HPYRROLE3CARBOXYLATE
InChI=1SC15H14BrNO3c132015(19)139(2)1712(14(13)18)81054611(16)710h4817H3H212H3b128+
MFCD03273086
ZINC000000089773
ZINC00089773
ZINC89773
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