Vitas-M small molecule compound

methyl 4-phenyl-3-(phenylcarbonyl)-4,5-dihydro-1H-pyrazole-5-carboxylate

Catalog ID
STK093679
SMILES COC(=O)C1NN=C(C1c1ccccc1)C(=O)c1ccccc1

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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 C18H16N2O3 MW 308.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16N2O3/c1-23-18(22)16-14(12-8-4-2-5-9-12)15(19-20-16)17(21)13-10-6-3-7-11-13/h2-11,14,16,20H,1H3
InChIKey
MKTBYSGQVNKKDE-UHFFFAOYSA-N
Synonyms

COC(=O)C1C(C(=NN1)C(=O)C2=CC=CC=C2)C3=CC=CC=C3
COC(=O)C1NN=C(C1c1ccccc1)C(=O)c1ccccc1
InChI=1SC18H16N2O3c12318(22)1614(128425912)15(192016)17(21)13106371113h211141620H1H3
METHYL3BENZOYL4PHENYL45DIHYDRO1HPYRAZOLE5CARBOXYLATE
METHYL4PHENYL3(PHENYLCARBONYL)45DIHYDRO1HPYRAZOLE5CARBOXYLATE
MFCD02215153
STK093679
ZINC000000174473
ZINC000004104471

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Available files

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