Vitas-M small molecule compound

methyl (4Z)-4-{[1-(3,4-dichlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate

Catalog ID
STK168559
SMILES COC(=O)C1=C(C)NC(=O)/C/1=C\c1cc(n(c1C)c1ccc(c(c1)Cl)Cl)C

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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 C20H18Cl2N2O3 MW 405.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18Cl2N2O3/c1-10-7-13(8-15-18(20(26)27-4)11(2)23-19(15)25)12(3)24(10)14-5-6-16(21)17(22)9-14/h5-9H,1-4H3,(H,23,25)/b15-8-
InChIKey
IHPRUDTWXNOQBA-NVNXTCNLSA-N
Synonyms

CC1=CC(=C(N1C2=CC(=C(C=C2)Cl)Cl)C)C=C3C(=C(NC3=O)C)C(=O)OC
COC(=O)C1=C(C)NC(=O)C1=Cc1cc(n(c1C)c1ccc(c(c1)Cl)Cl)C
InChI=1SC20H18Cl2N2O3c110713(81518(20(26)274)11(2)2319(15)25)12(3)24(10)145616(21)17(22)914h59H14H3(H2325)b158
METHYL(4Z)4((1(34DICHLOROPHENYL)25DIMETHYL1HPYRROL3YL)METHYLIDENE)2METHYL5OXO45DIHYDRO1HPYRROLE3CARBOXYLATE
METHYL(4Z)4((1(34DICHLOROPHENYL)25DIMETHYLPYRROL3YL)METHYLIDENE)2METHYL5OXO1HPYRROLE3CARBOXYLATE
METHYL4((1(34DICHLOROPHENYL)25DIMETHYL1HPYRROL3YL)METHYLENE)2METHYL5OXO45DIHYDRO1HPYRROLE3CARBOXYLATE
MFCD03235390
ZINC000014010580
ZINC14010580

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.