ethyl 1-(3,5-dimethylphenyl)-5-methylsulfonyl-pyrazole-4-carboxylate

Systemtic Name: ethyl 1-(3,5-dimethylphenyl)-5-methylsulfonyl-pyrazole-4-carboxylate Openeye Name: ethyl 1-(3,5-dimethylphenyl)-5-methylsulfonyl-pyrazole-4-carboxylate CAS Name: 1-(3,5-dimethylphenyl)-5-methylsulfonyl-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(3,5-dimethylphenyl)-5-methylsulfonylpyrazole-4-carboxylate Traditional Name: 1-(3,5-dimethylphenyl)-5-mesyl-pyrazole-4-carboxylic acid ethyl ester Formula: C15H18N2O4S MolecularWeight: 322.37942

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=CC(=CC(=C2)C)C)S(=O)(=O)C

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=CC(=CC(=C2)C)C)S(=O)(=O)C

InChI

InChI=1S/C15H18N2O4S/c1-5-21-15(18)13-9-16-17(14(13)22(4,19)20)12-7-10(2)6-11(3)8-12/h6-9H,5H2,1-4H3