Vitas-M small molecule compound

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

Catalog ID
STK160869
SMILES COC(=O)C1=C(C)N/C(=C\c2cc(n(c2C)c2cccc(c2Cl)Cl)C)/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 C20H18Cl2N2O3 MW 405.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18Cl2N2O3/c1-10-8-13(9-15-19(25)17(11(2)23-15)20(26)27-4)12(3)24(10)16-7-5-6-14(21)18(16)22/h5-9,23H,1-4H3/b15-9-
InChIKey
BYAUPCVFVJCQOO-DHDCSXOGSA-N
Synonyms
CC1=CC(=C(N1C2=C(C(=CC=C2)Cl)Cl)C)C=C3C(=O)C(=C(N3)C)C(=O)OC
COC(=O)C1=C(C)NC(=Cc2cc(n(c2C)c2cccc(c2Cl)Cl)C)C1=O
METHYL(5Z)5((1(23DICHLOROPHENYL)25DIMETHYL1HPYRROL3YL)METHYLIDENE)2METHYL4OXO45DIHYDRO1HPYRROLE3CARBOXYLATE
METHYL(5Z)5((1(23DICHLOROPHENYL)25DIMETHYLPYRROL3YL)METHYLIDENE)2METHYL4OXO1HPYRROLE3CARBOXYLATE
Registry IDs
MFCD04087201
ZINC000019859107
ZINC19859107

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Available files

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