ethyl 5-methyl-2-(3-methylsulfanylphenyl)pyrazole-3-carboxylate

Systemtic Name: ethyl 5-methyl-2-(3-methylsulfanylphenyl)pyrazole-3-carboxylate Openeye Name: ethyl 5-methyl-2-(3-methylsulfanylphenyl)pyrazole-3-carboxylate CAS Name: 5-methyl-2-[3-(methylthio)phenyl]-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-methyl-2-(3-methylsulfanylphenyl)pyrazole-3-carboxylate Traditional Name: 5-methyl-2-[3-(methylthio)phenyl]pyrazole-3-carboxylic acid ethyl ester Formula: C14H16N2O2S MolecularWeight: 276.35404

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=NN1C2=CC(=CC=C2)SC)C

Isomeric SMILES

CCOC(=O)C1=CC(=NN1C2=CC(=CC=C2)SC)C

InChI

InChI=1S/C14H16N2O2S/c1-4-18-14(17)13-8-10(2)15-16(13)11-6-5-7-12(9-11)19-3/h5-9H,4H2,1-3H3