Vitas-M small molecule compound

(E)-{2-(2-chlorophenyl)-1-[2-(dimethylammonio)ethyl]-4,5-dioxopyrrolidin-3-ylidene}(phenyl)methanolate

Catalog ID
STL149809
SMILES C[NH+](CCN1C(=O)C(=O)/C(=C(\c2ccccc2)/[O-])/C1c1ccccc1Cl)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 C21H21ClN2O3 MW 384.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21ClN2O3/c1-23(2)12-13-24-18(15-10-6-7-11-16(15)22)17(20(26)21(24)27)19(25)14-8-4-3-5-9-14/h3-11,18,25H,12-13H2,1-2H3/b19-17+
InChIKey
KMVYOORRELZUEY-HTXNQAPBSA-N
Synonyms

(4E)5(2chlorophenyl)1(2(dimethylamino)ethyl)4(hydroxy(phenyl)methylidene)pyrrolidine23dione
(4E)5(2CHLOROPHENYL)1(2DIMETHYLAMINOETHYL)4(HYDROXY(PHENYL)METHYLIDENE)PYRROLIDINE23DIONE
(E)(2(2chlorophenyl)1(2(dimethylammonio)ethyl)45dioxopyrrolidin3ylidene)(phenyl)methanolate
(E)(2(2CHLOROPHENYL)1(2(DIMETHYLAZANIUMYL)ETHYL)45DIOXOPYRROLIDIN3YLIDENE)PHENYLMETHANOLATE
1(2(DIMETHYLAMINO)ETHYL)5(2CHLOROPHENYL)3HYDROXY4(PHENYLCARBONYL)3PYRROLIN2ONE
4BENZOYL5(2CHLOROPHENYL)1(2(DIMETHYLAMINO)ETHYL)3HYDROXY15DIHYDRO2HPYRROL2ONE
C(NH+)(CCN1C(=O)C(=O)C(=C(c2ccccc2)(O))C1c1ccccc1Cl)C
CN(C)CCN1C(C(=C(C2=CC=CC=C2)O)C(=O)C1=O)C3=CC=CC=C3Cl
InChI=1SC21H21ClN2O3c123(2)12132418(1510671116(15)22)17(20(26)21(24)27)19(25)148435914h3111825H1213H212H3b1917+
MFCD20755677
ZINC000004427707
ZINC000004427708

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Available files

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