Vitas-M small molecule compound

3-(ethylcarbamoyl)-1-methyl-1H-pyrazole-5-carboxylic acid

Catalog ID
STL415255
SMILES Cn1nc(cc1C(=O)O)C(=O)NCC

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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 C8H11N3O3 MW 197.19 g/mol Purity >90% as per NMR
InChI
InChI=1S/C8H11N3O3/c1-3-9-7(12)5-4-6(8(13)14)11(2)10-5/h4H,3H2,1-2H3,(H,9,12)(H,13,14)
InChIKey
VEMBHUNAZCSVPV-UHFFFAOYSA-N
Synonyms
1429419-20-4
1429419204
3(ethylcarbamoyl)1methyl1Hpyrazole5carboxylicacid
5(ethylcarbamoyl)2methylpyrazole3carboxylicacid
CCNC(=O)C1=NN(C(=C1)C(=O)O)C
InChI=1SC8H11N3O3c1397(12)546(8(13)14)11(2)105h4H3H212H3(H912)(H1314)
MFCD25371340
ZINC000095098572
ZINC95098572

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Available files

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