Vitas-M small molecule compound

(3,5-dimethyl-1H-pyrazol-1-yl)(4-ethoxyphenyl)methanone

Catalog ID
STK334523
SMILES CCOc1ccc(cc1)C(=O)n1nc(cc1C)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 C14H16N2O2 MW 244.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H16N2O2/c1-4-18-13-7-5-12(6-8-13)14(17)16-11(3)9-10(2)15-16/h5-9H,4H2,1-3H3
InChIKey
BOHPFTHAEPYMCS-UHFFFAOYSA-N
Synonyms
416889-94-6
(35dimethyl1Hpyrazol1yl)(4ethoxyphenyl)methanone
(35DIMETHYLPYRAZOL1YL)(4ETHOXYPHENYL)METHANONE
1(4ETHOXYBENZOYL)35DIMETHYL1HPYRAZOLE
35DIMETHYLPYRAZOLYL4ETHOXYPHENYLKETONE
416889946
CCOC1=CC=C(C=C1)C(=O)N2C(=CC(=N2)C)C
InChI=1SC14H16N2O2c1418137512(6813)14(17)1611(3)910(2)1516h59H4H213H3
MFCD00980869
ZINC000000437001
ZINC00437001
ZINC437001

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Available files

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