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(E)-{1-[2-(dimethylammonio)ethyl]-2-(4-methylphenyl)-4,5-dioxopyrrolidin-3-ylidene}(5-methyl-1-phenyl-1H-pyrazol-4-yl)methanolate

Catalog ID
STL047071
SMILES C[NH+](CCN1C(c2ccc(cc2)C)/C(=C(/c2cnn(c2C)c2ccccc2)\[O-])/C(=O)C1=O)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 C26H28N4O3 MW 444.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H28N4O3/c1-17-10-12-19(13-11-17)23-22(25(32)26(33)29(23)15-14-28(3)4)24(31)21-16-27-30(18(21)2)20-8-6-5-7-9-20/h5-13,16,23,31H,14-15H2,1-4H3/b24-22+
InChIKey
JGCQOUZRZXVLQY-ZNTNEXAZSA-N
Synonyms
955895-98-4
(4E)1(2DIMETHYLAMINOETHYL)4(HYDROXY(5METHYL1PHENYLPYRAZOL4YL)METHYLIDENE)5(4METHYLPHENYL)PYRROLIDINE23DIONE
(4Z)1(2DIMETHYLAMINOETHYL)4(HYDROXY(5METHYL1PHENYLPYRAZOL4YL)METHYLIDENE)5(4METHYLPHENYL)PYRROLIDINE23DIONE
(E)(1(2(dimethylammonio)ethyl)2(4methylphenyl)45dioxopyrrolidin3ylidene)(5methyl1phenyl1Hpyrazol4yl)methanolate
(E)(1(2(DIMETHYLAZANIUMYL)ETHYL)2(4METHYLPHENYL)45DIOXOPYRROLIDIN3YLIDENE)(5METHYL1PHENYLPYRAZOL4YL)METHANOLATE
1(2(DIMETHYLAMINO)ETHYL)3HYDROXY5(4METHYLPHENYL)4((5METHYL1PHENYLPYRAZOL4YL)CARBONYL)3PYRROLIN2ONE
1(2DIMETHYLAMINOETHYL)3HYDROXY4(5METHYL1PHENYL1HPYRAZOLE4CARBONYL)5PTOLYL15DIHYDROPYRROL2ONE
955895984
C(NH+)(CCN1C(c2ccc(cc2)C)C(=C(c2cnn(c2C)c2ccccc2)(O))C(=O)C1=O)C
CC1=CC=C(C=C1)C2C(=C(C3=C(N(N=C3)C4=CC=CC=C4)C)(O))C(=O)C(=O)N2CC(NH+)(C)C
InChI=1SC26H28N4O3c117101219(131117)2322(25(32)26(33)29(23)151428(3)4)24(31)21162730(18(21)2)208657920h513162331H1415H214H3b2422+
MFCD18248986
ZINC000009008090
ZINC000009008091

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Available files

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