Vitas-M small molecule compound

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

Catalog ID
STK588221
SMILES Clc1ccc(cc1)C1/C(=C(/c2ccccc2)\[O-])/C(=O)C(=O)N1c1ccc(cc1)[NH+](C)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 C25H21ClN2O3 MW 432.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21ClN2O3/c1-27(2)19-12-14-20(15-13-19)28-22(16-8-10-18(26)11-9-16)21(24(30)25(28)31)23(29)17-6-4-3-5-7-17/h3-15,22,29H,1-2H3/b23-21+
InChIKey
JGIXGZPRIAAVOA-XTQSDGFTSA-N
Synonyms
498537-76-1
(4E)5(4CHLOROPHENYL)1(4DIMETHYLAMINOPHENYL)4(HYDROXY(PHENYL)METHYLIDENE)PYRROLIDINE23DIONE
(E)(2(4chlorophenyl)1(4(dimethylammonio)phenyl)45dioxopyrrolidin3ylidene)(phenyl)methanolate
(E)(2(4chlorophenyl)1(4(dimethylazaniumyl)phenyl)45dioxopyrrolidin3ylidene)phenylmethanolate
498537761
C(NH+)(C)C1=CC=C(C=C1)N2C(C(=C(C3=CC=CC=C3)(O))C(=O)C2=O)C4=CC=C(C=C4)Cl
Clc1ccc(cc1)C1C(=C(c2ccccc2)(O))C(=O)C(=O)N1c1ccc(cc1)(NH+)(C)C
InChI=1SC25H21ClN2O3c127(2)19121420(151319)2822(1681018(26)11916)21(24(30)25(28)31)23(29)176435717h3152229H12H3b2321+
MFCD07206881
ZINC000102603006
ZINC000102603013

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Available files

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