6-oxidanyl-3-phenyl-5-phenylsulfanyl-1H-pyridazin-4-one

Systemtic Name: 6-oxidanyl-3-phenyl-5-phenylsulfanyl-1H-pyridazin-4-one Openeye Name: 6-hydroxy-3-phenyl-5-phenylsulfanyl-1H-pyridazin-4-one CAS Name: 6-hydroxy-3-phenyl-5-(phenylthio)-1H-pyridazin-4-one IUPAC Name: 6-hydroxy-3-phenyl-5-phenylsulfanyl-1H-pyridazin-4-one Traditional Name: 6-hydroxy-3-phenyl-5-(phenylthio)-1H-pyridazin-4-one Formula: C16H12N2O2S MolecularWeight: 296.34368

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NNC(=C(C2=O)SC3=CC=CC=C3)O

Isomeric SMILES

C1=CC=C(C=C1)C2=NNC(=C(C2=O)SC3=CC=CC=C3)O

InChI

InChI=1S/C16H12N2O2S/c19-14-13(11-7-3-1-4-8-11)17-18-16(20)15(14)21-12-9-5-2-6-10-12/h1-10H,(H2,18,19,20)