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(E)-{1-[3-(dimethylammonio)propyl]-4,5-dioxo-2-phenylpyrrolidin-3-ylidene}(5-methyl-1-phenyl-1H-pyrazol-4-yl)methanolate

Catalog ID
STL044086
SMILES C[NH+](CCCN1C(c2ccccc2)/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/c1-18-21(17-27-30(18)20-13-8-5-9-14-20)24(31)22-23(19-11-6-4-7-12-19)29(26(33)25(22)32)16-10-15-28(2)3/h4-9,11-14,17,23,31H,10,15-16H2,1-3H3/b24-22+
InChIKey
FELHINBSEBGECH-ZNTNEXAZSA-N
Synonyms
908229-11-8
(4E)1(3(DIMETHYLAMINO)PROPYL)4(HYDROXY(5METHYL1PHENYLPYRAZOL4YL)METHYLIDENE)5PHENYLPYRROLIDINE23DIONE
(4Z)1(3(DIMETHYLAMINO)PROPYL)4(HYDROXY(5METHYL1PHENYLPYRAZOL4YL)METHYLIDENE)5PHENYLPYRROLIDINE23DIONE
(E)(1(3(dimethylammonio)propyl)45dioxo2phenylpyrrolidin3ylidene)(5methyl1phenyl1Hpyrazol4yl)methanolate
(E)(1(3(DIMETHYLAZANIUMYL)PROPYL)45DIOXO2PHENYLPYRROLIDIN3YLIDENE)(5METHYL1PHENYLPYRAZOL4YL)METHANOLATE
1(3(DIMETHYLAMINO)PROPYL)3HYDROXY4((5METHYL1PHENYLPYRAZOL4YL)CARBONYL)5PHENYL3PYRROLIN2ONE
908229118
C(NH+)(CCCN1C(c2ccccc2)C(=C(c2cnn(c2C)c2ccccc2)(O))C(=O)C1=O)C
CC1=C(C=NN1C2=CC=CC=C2)C(=C3C(N(C(=O)C3=O)CCC(NH+)(C)C)C4=CC=CC=C4)(O)
InChI=1SC26H28N4O3c11821(172730(18)20138591420)24(31)2223(19116471219)29(26(33)25(22)32)16101528(2)3h491114172331H101516H213H3b2422+
MFCD18248344
ZINC000102873643
ZINC000102873646

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Available files

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