Vitas-M small molecule compound
ethyl (4Z)-4-(4-bromobenzylidene)-1-(2-methoxyethyl)-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Catalog ID
STK168320
SMILES COCCN1C(=O)/C(=C\c2ccc(cc2)Br)/C(=C1C)C(=O)OCC
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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 C18H20BrNO4 MW 394.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20BrNO4/c1-4-24-18(22)16-12(2)20(9-10-23-3)17(21)15(16)11-13-5-7-14(19)8-6-13/h5-8,11H,4,9-10H2,1-3H3/b15-11-InChIKey
ZCHHRACJUNAKHE-PTNGSMBKSA-NSynonyms
CCOC(=O)C1=C(N(C(=O)C1=CC2=CC=C(C=C2)Br)CCOC)C
COCCN1C(=O)C(=Cc2ccc(cc2)Br)C(=C1C)C(=O)OCC
ETHYL(4Z)4((4BROMOPHENYL)METHYLIDENE)1(2METHOXYETHYL)2METHYL5OXOPYRROLE3CARBOXYLATE
ETHYL(4Z)4(4BROMOBENZYLIDENE)1(2METHOXYETHYL)2METHYL5OXO45DIHYDRO1HPYRROLE3CARBOXYLATE
InChI=1SC18H20BrNO4c142418(22)1612(2)20(910233)17(21)15(16)11135714(19)8613h5811H4910H213H3b1511
MFCD01153752
ZINC000014010479
ZINC14010479
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