2-(4-chlorophenyl)-5-(pyridin-2-ylsulfanylmethyl)-1H-pyrazol-3-one

Systemtic Name: 2-(4-chlorophenyl)-5-(pyridin-2-ylsulfanylmethyl)-1H-pyrazol-3-one Openeye Name: 2-(4-chlorophenyl)-5-(2-pyridylsulfanylmethyl)-1H-pyrazol-3-one CAS Name: 2-(4-chlorophenyl)-5-[(2-pyridinylthio)methyl]-1H-pyrazol-3-one IUPAC Name: 2-(4-chlorophenyl)-5-(pyridin-2-ylsulfanylmethyl)-1H-pyrazol-3-one Traditional Name: 2-(4-chlorophenyl)-5-[(2-pyridylthio)methyl]-3-pyrazolin-3-one Formula: C15H12ClN3OS MolecularWeight: 317.79328

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)SCC2=CC(=O)N(N2)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC=NC(=C1)SCC2=CC(=O)N(N2)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C15H12ClN3OS/c16-11-4-6-13(7-5-11)19-15(20)9-12(18-19)10-21-14-3-1-2-8-17-14/h1-9,18H,10H2