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

Systemtic Name: methyl 4-[(E)-hydroxyiminomethyl]-1-phenyl-5-phenylsulfanyl-pyrazole-3-carboxylate Openeye Name: methyl 4-[(E)-hydroxyiminomethyl]-1-phenyl-5-phenylsulfanyl-pyrazole-3-carboxylate CAS Name: 4-[(E)-hydroxyiminomethyl]-1-phenyl-5-(phenylthio)-3-pyrazolecarboxylic acid methyl ester IUPAC Name: methyl 4-[(E)-hydroxyiminomethyl]-1-phenyl-5-phenylsulfanylpyrazole-3-carboxylate Traditional Name: 4-[(E)-hydroximinomethyl]-1-phenyl-5-(phenylthio)pyrazole-3-carboxylic acid methyl ester Formula: C18H15N3O3S MolecularWeight: 353.395

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=NN(C(=C1C=NO)SC2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=NN(C(=C1/C=N/O)SC2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C18H15N3O3S/c1-24-18(22)16-15(12-19-23)17(25-14-10-6-3-7-11-14)21(20-16)13-8-4-2-5-9-13/h2-12,23H,1H3/b19-12+