Vitas-M small molecule compound

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

Catalog ID
STK699221
SMILES CCOC(=O)C1=C(C)N(C(=O)/C/1=C\c1ccc(c(c1)Cl)Cl)c1ccc(cc1)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 C23H21Cl2NO4 MW 446.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21Cl2NO4/c1-4-29-17-9-7-16(8-10-17)26-14(3)21(23(28)30-5-2)18(22(26)27)12-15-6-11-19(24)20(25)13-15/h6-13H,4-5H2,1-3H3/b18-12-
InChIKey
LMSCRERQRPTMAK-PDGQHHTCSA-N
Synonyms

CCOC(=O)C1=C(C)N(C(=O)C1=Cc1ccc(c(c1)Cl)Cl)c1ccc(cc1)OCC
CCOC1=CC=C(C=C1)N2C(=C(C(=CC3=CC(=C(C=C3)Cl)Cl)C2=O)C(=O)OCC)C
ETHYL(4Z)4((34DICHLOROPHENYL)METHYLIDENE)1(4ETHOXYPHENYL)2METHYL5OXOPYRROLE3CARBOXYLATE
ethyl(4Z)4(34dichlorobenzylidene)1(4ethoxyphenyl)2methyl5oxo45dihydro1Hpyrrole3carboxylate
InChI=1SC23H21Cl2NO4c1429179716(81017)2614(3)21(23(28)3052)18(22(26)27)121561119(24)20(25)1315h613H45H213H3b1812
MFCD03820556
ZINC000003626436
ZINC03626436
ZINC3626436

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Available files

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