Vitas-M small molecule compound

methyl 3-[(4-cyanophenyl)carbamoyl]-1-methyl-1H-pyrazole-5-carboxylate

Catalog ID
STK502054
SMILES COC(=O)c1cc(nn1C)C(=O)Nc1ccc(cc1)C#N

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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 C14H12N4O3 MW 284.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H12N4O3/c1-18-12(14(20)21-2)7-11(17-18)13(19)16-10-5-3-9(8-15)4-6-10/h3-7H,1-2H3,(H,16,19)
InChIKey
JEOGVXJROPPVCK-UHFFFAOYSA-N
Synonyms

1HPYRAZOLE5CARBOXYLICACID3(((4CYANOPHENYL)AMINO)CARBONYL)1METHYLMETHYLESTER
CN1C(=CC(=N1)C(=O)NC2=CC=C(C=C2)C#N)C(=O)OC
InChI=1SC14H12N4O3c11812(14(20)212)711(1718)13(19)1610539(815)4610h37H12H3(H1619)
methyl3((4cyanophenyl)carbamoyl)1methyl1Hpyrazole5carboxylate
METHYL5((4CYANOPHENYL)CARBAMOYL)2METHYLPYRAZOLE3CARBOXYLATE
MFCD07022514
ZINC000004770286
ZINC04770286
ZINC4770286

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Available files

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