2-(4-fluorophenyl)-5-[(4-methylphenyl)sulfanylmethyl]-1H-pyrazol-3-one

Systemtic Name: 2-(4-fluorophenyl)-5-[(4-methylphenyl)sulfanylmethyl]-1H-pyrazol-3-one Openeye Name: 2-(4-fluorophenyl)-5-(p-tolylsulfanylmethyl)-1H-pyrazol-3-one CAS Name: 2-(4-fluorophenyl)-5-[[(4-methylphenyl)thio]methyl]-1H-pyrazol-3-one IUPAC Name: 2-(4-fluorophenyl)-5-[(4-methylphenyl)sulfanylmethyl]-1H-pyrazol-3-one Traditional Name: 2-(4-fluorophenyl)-5-[(p-tolylthio)methyl]-3-pyrazolin-3-one Formula: C17H15FN2OS MolecularWeight: 314.377203

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCC2=CC(=O)N(N2)C3=CC=C(C=C3)F

Isomeric SMILES

CC1=CC=C(C=C1)SCC2=CC(=O)N(N2)C3=CC=C(C=C3)F

InChI

InChI=1S/C17H15FN2OS/c1-12-2-8-16(9-3-12)22-11-14-10-17(21)20(19-14)15-6-4-13(18)5-7-15/h2-10,19H,11H2,1H3