methyl 4-[(E)-hydroxyiminomethyl]-5-(4-methylphenyl)sulfanyl-1-phenyl-pyrazole-3-carboxylate

Systemtic Name: methyl 4-[(E)-hydroxyiminomethyl]-5-(4-methylphenyl)sulfanyl-1-phenyl-pyrazole-3-carboxylate Openeye Name: methyl 4-[(E)-hydroxyiminomethyl]-1-phenyl-5-(p-tolylsulfanyl)pyrazole-3-carboxylate CAS Name: 4-[(E)-hydroxyiminomethyl]-5-[(4-methylphenyl)thio]-1-phenyl-3-pyrazolecarboxylic acid methyl ester IUPAC Name: methyl 4-[(E)-hydroxyiminomethyl]-5-(4-methylphenyl)sulfanyl-1-phenylpyrazole-3-carboxylate Traditional Name: 4-[(E)-hydroximinomethyl]-1-phenyl-5-(p-tolylthio)pyrazole-3-carboxylic acid methyl ester Formula: C19H17N3O3S MolecularWeight: 367.42158

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2=C(C(=NN2C3=CC=CC=C3)C(=O)OC)C=NO

Isomeric SMILES

CC1=CC=C(C=C1)SC2=C(C(=NN2C3=CC=CC=C3)C(=O)OC)/C=N/O

InChI

InChI=1S/C19H17N3O3S/c1-13-8-10-15(11-9-13)26-18-16(12-20-24)17(19(23)25-2)21-22(18)14-6-4-3-5-7-14/h3-12,24H,1-2H3/b20-12+