1-phenyl-4-pyridin-2-ylsulfanyl-pyrazolidin-3-one

Systemtic Name: 1-phenyl-4-pyridin-2-ylsulfanyl-pyrazolidin-3-one Openeye Name: 1-phenyl-4-(2-pyridylsulfanyl)pyrazolidin-3-one CAS Name: 1-phenyl-4-(2-pyridinylthio)-3-pyrazolidinone IUPAC Name: 1-phenyl-4-pyridin-2-ylsulfanylpyrazolidin-3-one Traditional Name: 1-phenyl-4-(2-pyridylthio)pyrazolidin-3-one Formula: C14H13N3OS MolecularWeight: 271.33752

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(=O)NN1C2=CC=CC=C2)SC3=CC=CC=N3

Isomeric SMILES

C1C(C(=O)NN1C2=CC=CC=C2)SC3=CC=CC=N3

InChI

InChI=1S/C14H13N3OS/c18-14-12(19-13-8-4-5-9-15-13)10-17(16-14)11-6-2-1-3-7-11/h1-9,12H,10H2,(H,16,18)