5-[bis(methylsulfanyl)methyl]-3-phenyl-1H-pyridazin-6-one

Systemtic Name: 5-[bis(methylsulfanyl)methyl]-3-phenyl-1H-pyridazin-6-one Openeye Name: 5-[bis(methylsulfanyl)methyl]-3-phenyl-1H-pyridazin-6-one CAS Name: 5-[bis(methylthio)methyl]-3-phenyl-1H-pyridazin-6-one IUPAC Name: 5-[bis(methylsulfanyl)methyl]-3-phenyl-1H-pyridazin-6-one Traditional Name: 5-[bis(methylthio)methyl]-3-phenyl-1H-pyridazin-6-one Formula: C13H14N2OS2 MolecularWeight: 278.39306

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Descriptors Computed from Structure

Canonical SMILES:

CSC(C1=CC(=NNC1=O)C2=CC=CC=C2)SC

Isomeric SMILES

CSC(C1=CC(=NNC1=O)C2=CC=CC=C2)SC

InChI

InChI=1S/C13H14N2OS2/c1-17-13(18-2)10-8-11(14-15-12(10)16)9-6-4-3-5-7-9/h3-8,13H,1-2H3,(H,15,16)