Vitas-M small molecule compound

dimethyl 1,3-diphenyl-4,5-dihydro-1H-pyrazole-4,5-dicarboxylate

Catalog ID
STK747572
SMILES COC(=O)C1C(C(=O)OC)C(=NN1c1ccccc1)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 C19H18N2O4 MW 338.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18N2O4/c1-24-18(22)15-16(13-9-5-3-6-10-13)20-21(17(15)19(23)25-2)14-11-7-4-8-12-14/h3-12,15,17H,1-2H3
InChIKey
DDSBFYRQWRIBIA-UHFFFAOYSA-N
Synonyms

COC(=O)C1C(N(N=C1C2=CC=CC=C2)C3=CC=CC=C3)C(=O)OC
dimethyl13diphenyl45dihydro1Hpyrazole45dicarboxylate
DIMETHYL25DIPHENYL34DIHYDROPYRAZOLE34DICARBOXYLATE
InChI=1SC19H18N2O4c12418(22)1516(1395361013)2021(17(15)19(23)252)14117481214h3121517H12H3
METHYL4(METHOXYCARBONYL)13DIPHENYL2PYRAZOLINE5CARBOXYLATE
MFCD00510077
ZINC000004012029
ZINC000004012032

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Available files

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