ethyl 1-methyl-5-methylsulfanyl-3-phenyl-pyrazole-4-carboxylate

Systemtic Name: ethyl 1-methyl-5-methylsulfanyl-3-phenyl-pyrazole-4-carboxylate Openeye Name: ethyl 1-methyl-5-methylsulfanyl-3-phenyl-pyrazole-4-carboxylate CAS Name: 1-methyl-5-(methylthio)-3-phenyl-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-methyl-5-methylsulfanyl-3-phenylpyrazole-4-carboxylate Traditional Name: 1-methyl-5-(methylthio)-3-phenyl-pyrazole-4-carboxylic acid ethyl ester Formula: C14H16N2O2S MolecularWeight: 276.35404

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1C2=CC=CC=C2)C)SC

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1C2=CC=CC=C2)C)SC

InChI

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