5-[(4-chlorophenyl)sulfanylmethyl]-2-phenyl-4H-pyrazol-3-one

Systemtic Name: 5-[(4-chlorophenyl)sulfanylmethyl]-2-phenyl-4H-pyrazol-3-one Openeye Name: 5-[(4-chlorophenyl)sulfanylmethyl]-2-phenyl-4H-pyrazol-3-one CAS Name: 5-[[(4-chlorophenyl)thio]methyl]-2-phenyl-4H-pyrazol-3-one IUPAC Name: 5-[(4-chlorophenyl)sulfanylmethyl]-2-phenyl-4H-pyrazol-3-one Traditional Name: 5-[[(4-chlorophenyl)thio]methyl]-2-phenyl-2-pyrazolin-3-one Formula: C16H13ClN2OS MolecularWeight: 316.80522

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=NN(C1=O)C2=CC=CC=C2)CSC3=CC=C(C=C3)Cl

Isomeric SMILES

C1C(=NN(C1=O)C2=CC=CC=C2)CSC3=CC=C(C=C3)Cl

InChI

InChI=1S/C16H13ClN2OS/c17-12-6-8-15(9-7-12)21-11-13-10-16(20)19(18-13)14-4-2-1-3-5-14/h1-9H,10-11H2