Vitas-M small molecule compound
methyl 3-acetyl-1-(4-chlorophenyl)-4,5-dihydro-1H-pyrazole-4-carboxylate
Catalog ID
STK325528
SMILES COC(=O)C1CN(N=C1C(=O)C)c1ccc(cc1)Cl
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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 C13H13ClN2O3 MW 280.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H13ClN2O3/c1-8(17)12-11(13(18)19-2)7-16(15-12)10-5-3-9(14)4-6-10/h3-6,11H,7H2,1-2H3InChIKey
ZWAFNJOZQPLMBJ-UHFFFAOYSA-NSynonyms
CC(=O)C1=NN(CC1C(=O)OC)C2=CC=C(C=C2)Cl
InChI=1SC13H13ClN2O3c18(17)1211(13(18)192)716(1512)10539(14)4610h3611H7H212H3
METHYL3ACETYL1(4CHLOROPHENYL)2PYRAZOLINE4CARBOXYLATE
methyl3acetyl1(4chlorophenyl)45dihydro1Hpyrazole4carboxylate
METHYL5ACETYL2(4CHLOROPHENYL)34DIHYDROPYRAZOLE4CARBOXYLATE
MFCD00762120
ZINC000000049467
ZINC000004281875
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