methyl 2-[4-[(E)-(3-fluorophenyl)methoxyiminomethyl]-2-methyl-5-phenyl-pyrazol-3-yl]sulfanylbenzoate

Systemtic Name: methyl 2-[4-[(E)-(3-fluorophenyl)methoxyiminomethyl]-2-methyl-5-phenyl-pyrazol-3-yl]sulfanylbenzoate Openeye Name: methyl 2-[4-[(E)-(3-fluorophenyl)methoxyiminomethyl]-2-methyl-5-phenyl-pyrazol-3-yl]sulfanylbenzoate CAS Name: 2-[[4-[(E)-(3-fluorophenyl)methoxyiminomethyl]-2-methyl-5-phenyl-3-pyrazolyl]thio]benzoic acid methyl ester IUPAC Name: methyl 2-[4-[(E)-(3-fluorophenyl)methoxyiminomethyl]-2-methyl-5-phenylpyrazol-3-yl]sulfanylbenzoate Traditional Name: 2-[[4-[(E)-(3-fluorobenzyl)oximinomethyl]-2-methyl-5-phenyl-pyrazol-3-yl]thio]benzoic acid methyl ester Formula: C26H22FN3O3S MolecularWeight: 475.534583

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=N1)C2=CC=CC=C2)C=NOCC3=CC(=CC=C3)F)SC4=CC=CC=C4C(=O)OC

Isomeric SMILES

CN1C(=C(C(=N1)C2=CC=CC=C2)/C=N/OCC3=CC(=CC=C3)F)SC4=CC=CC=C4C(=O)OC

InChI

InChI=1S/C26H22FN3O3S/c1-30-25(34-23-14-7-6-13-21(23)26(31)32-2)22(24(29-30)19-10-4-3-5-11-19)16-28-33-17-18-9-8-12-20(27)15-18/h3-16H,17H2,1-2H3/b28-16+