Vitas-M small molecule compound

3-{[(1,3-dimethyl-1H-pyrazol-5-yl)methyl]carbamoyl}-1-methyl-1H-pyrazole-4-carboxylic acid

Catalog ID
STK352487
SMILES Cn1cc(c(n1)C(=O)NCc1cc(nn1C)C)C(=O)O

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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 C12H15N5O3 MW 277.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H15N5O3/c1-7-4-8(17(3)14-7)5-13-11(18)10-9(12(19)20)6-16(2)15-10/h4,6H,5H2,1-3H3,(H,13,18)(H,19,20)
InChIKey
MIOLMRQKRYCQNP-UHFFFAOYSA-N
Synonyms
1171022-40-4
1171022404
3(((13dimethyl1Hpyrazol5yl)methyl)carbamoyl)1methyl1Hpyrazole4carboxylicacid
3((25dimethylpyrazol3yl)methylcarbamoyl)1methylpyrazole4carboxylicacid
3(N((13DIMETHYLPYRAZOL5YL)METHYL)CARBAMOYL)1METHYLPYRAZOLE4CARBOXYLICACID
CC1=NN(C(=C1)CNC(=O)C2=NN(C=C2C(=O)O)C)C
InChI=1SC12H15N5O3c1748(17(3)147)51311(18)109(12(19)20)616(2)1510h46H5H213H3(H1318)(H1920)
MFCD09473981
ZINC000012397476
ZINC12397476

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Available files

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