Vitas-M small molecule compound
ethyl (4Z)-4-(3,4-dichlorobenzylidene)-2-methyl-5-oxo-1-phenyl-4,5-dihydro-1H-pyrrole-3-carboxylate
Catalog ID
STK804813
SMILES CCOC(=O)C1=C(C)N(C(=O)/C/1=C\c1ccc(c(c1)Cl)Cl)c1ccccc1
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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 C21H17Cl2NO3 MW 402.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17Cl2NO3/c1-3-27-21(26)19-13(2)24(15-7-5-4-6-8-15)20(25)16(19)11-14-9-10-17(22)18(23)12-14/h4-12H,3H2,1-2H3/b16-11-InChIKey
SJEFUDIBSPMDCG-WJDWOHSUSA-NSynonyms
331637-41-3(Z)ethyl4(34dichlorobenzylidene)2methyl5oxo1phenyl45dihydro1Hpyrrole3carboxylate
331637413
CCOC(=O)C1=C(C)N(C(=O)C1=Cc1ccc(c(c1)Cl)Cl)c1ccccc1
CCOC(=O)C1=C(N(C(=O)C1=CC2=CC(=C(C=C2)Cl)Cl)C3=CC=CC=C3)C
ETHYL(4Z)4((34DICHLOROPHENYL)METHYLIDENE)2METHYL5OXO1PHENYLPYRROLE3CARBOXYLATE
ethyl(4Z)4(34dichlorobenzylidene)2methyl5oxo1phenyl45dihydro1Hpyrrole3carboxylate
InChI=1SC21H17Cl2NO3c132721(26)1913(2)24(157546815)20(25)16(19)111491017(22)18(23)1214h412H3H212H3b1611
MFCD01153350
ZINC000013602899
ZINC13602899
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