Vitas-M small molecule compound

1-[(4-chloro-3-ethoxyphenyl)sulfonyl]-3,5-dimethyl-1H-pyrazole

Catalog ID
STK354296
SMILES CCOc1cc(ccc1Cl)S(=O)(=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 C13H15ClN2O3S MW 314.79 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H15ClN2O3S/c1-4-19-13-8-11(5-6-12(13)14)20(17,18)16-10(3)7-9(2)15-16/h5-8H,4H2,1-3H3
InChIKey
ZAEAHXXAXQQBBE-UHFFFAOYSA-N
Synonyms
1015846-16-8
1((4chloro3ethoxyphenyl)sulfonyl)35dimethyl1Hpyrazole
1(4chloro3ethoxyphenyl)sulfonyl35dimethylpyrazole
1015846168
4((35DIMETHYLPYRAZOLYL)SULFONYL)1CHLORO2ETHOXYBENZENE
CCOC1=C(C=CC(=C1)S(=O)(=O)N2C(=CC(=N2)C)C)Cl
InChI=1SC13H15ClN2O3Sc141913811(5612(13)14)20(1718)1610(3)79(2)1516h58H4H213H3
MFCD09871043
ZINC000016577105
ZINC16577105

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Available files

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