Vitas-M small molecule compound

3-(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)-1-(4-methyl-1H-pyrazol-1-yl)propan-1-one

Catalog ID
STL394987
SMILES Cc1cnn(c1)C(=O)CCn1nc(c(c1C)Cl)C

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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 C12H15ClN4O MW 266.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H15ClN4O/c1-8-6-14-17(7-8)11(18)4-5-16-10(3)12(13)9(2)15-16/h6-7H,4-5H2,1-3H3
InChIKey
MJQNFGHTZQNYAR-UHFFFAOYSA-N
Synonyms
1005684-57-0
1005684570
3(4CHLORO35DIMETHYL1HPYRAZOL1YL)1(4METHYL1HPYRAZOL1YL)PROPAN1ONE
3(4CHLORO35DIMETHYLPYRAZOL1YL)1(4METHYLPYRAZOL1YL)PROPAN1ONE
CC1=CN(N=C1)C(=O)CCN2C(=C(C(=N2)C)Cl)C
InChI=1SC12H15ClN4Oc1861417(78)11(18)451610(3)12(13)9(2)1516h67H45H213H3
MFCD04044657
ZINC000002781865
ZINC02781865
ZINC2781865

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Available files

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