Vitas-M small molecule compound

methyl (5E)-5-(2,4-dichlorobenzylidene)-2-methyl-4-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate

Catalog ID
STL296450
SMILES COC(=O)C1=C(C)N/C(=C/c2ccc(cc2Cl)Cl)/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 C14H11Cl2NO3 MW 312.15 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H11Cl2NO3/c1-7-12(14(19)20-2)13(18)11(17-7)5-8-3-4-9(15)6-10(8)16/h3-6,17H,1-2H3/b11-5+
InChIKey
ZZQUDQYWQOOWCR-VZUCSPMQSA-N
Synonyms

(E)methyl5(24dichlorobenzylidene)2methyl4oxo45dihydro1Hpyrrole3carboxylate
CC1=C(C(=O)C(=CC2=C(C=C(C=C2)Cl)Cl)N1)C(=O)OC
COC(=O)C1=C(C)NC(=Cc2ccc(cc2Cl)Cl)C1=O
InChI=1SC14H11Cl2NO3c1712(14(19)202)13(18)11(177)58349(15)610(8)16h3617H12H3b115+
METHYL(5E)5((24DICHLOROPHENYL)METHYLIDENE)2METHYL4OXO1HPYRROLE3CARBOXYLATE
methyl(5E)5(24dichlorobenzylidene)2methyl4oxo45dihydro1Hpyrrole3carboxylate
MFCD01541029
ZINC000002495244
ZINC02495244
ZINC2495244

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Available files

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