Vitas-M small molecule compound

3-{[(1,3-diphenyl-1H-pyrazol-5-yl)amino]methylidene}pentane-2,4-dione

Catalog ID
STK751405
SMILES CC(=O)C(=CNc1cc(nn1c1ccccc1)c1ccccc1)C(=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 C21H19N3O2 MW 345.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19N3O2/c1-15(25)19(16(2)26)14-22-21-13-20(17-9-5-3-6-10-17)23-24(21)18-11-7-4-8-12-18/h3-14,22H,1-2H3
InChIKey
BMXPYAWOYRTNTL-UHFFFAOYSA-N
Synonyms

3(((13diphenyl1Hpyrazol5yl)amino)methylidene)pentane24dione
3(((25DIPHENYLPYRAZOL3YL)AMINO)METHYLIDENE)PENTANE24DIONE
3((25DIPHENYL2HPYRAZOL3YLAMINO)METHYLENE)PENTANE24DIONE
CC(=O)C(=CNC1=CC(=NN1C2=CC=CC=C2)C3=CC=CC=C3)C(=O)C
InChI=1SC21H19N3O2c115(25)19(16(2)26)1422211320(1795361017)2324(21)18117481218h31422H12H3
MFCD00501595
ZINC000000060401
ZINC00060401
ZINC60401

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Available files

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