Vitas-M small molecule compound
methyl (4Z)-4-(4-bromobenzylidene)-1-ethyl-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Catalog ID
STK160020
SMILES CCN1C(=O)/C(=C\c2ccc(cc2)Br)/C(=C1C)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 C16H16BrNO3 MW 350.21 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16BrNO3/c1-4-18-10(2)14(16(20)21-3)13(15(18)19)9-11-5-7-12(17)8-6-11/h5-9H,4H2,1-3H3/b13-9-InChIKey
SDCYUFOCEJZOCT-LCYFTJDESA-NSynonyms
CCN1C(=C(C(=CC2=CC=C(C=C2)Br)C1=O)C(=O)OC)C
CCN1C(=O)C(=Cc2ccc(cc2)Br)C(=C1C)C(=O)OC
InChI=1SC16H16BrNO3c141810(2)14(16(20)213)13(15(18)19)9115712(17)8611h59H4H213H3b139
METHYL(4Z)4((4BROMOPHENYL)METHYLIDENE)1ETHYL2METHYL5OXOPYRROLE3CARBOXYLATE
METHYL(4Z)4(4BROMOBENZYLIDENE)1ETHYL2METHYL5OXO45DIHYDRO1HPYRROLE3CARBOXYLATE
MFCD01893977
ZINC000001199210
ZINC01199210
ZINC1199210
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