5-methoxy-2-phenyl-4-(phenylmethylsulfanyl)pyridazin-3-one

Systemtic Name: 5-methoxy-2-phenyl-4-(phenylmethylsulfanyl)pyridazin-3-one Openeye Name: 4-benzylsulfanyl-5-methoxy-2-phenyl-pyridazin-3-one CAS Name: 5-methoxy-2-phenyl-4-(phenylmethylthio)-3-pyridazinone IUPAC Name: 4-benzylsulfanyl-5-methoxy-2-phenylpyridazin-3-one Traditional Name: 4-(benzylthio)-5-methoxy-2-phenyl-pyridazin-3-one Formula: C18H16N2O2S MolecularWeight: 324.39684

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=O)N(N=C1)C2=CC=CC=C2)SCC3=CC=CC=C3

Isomeric SMILES

COC1=C(C(=O)N(N=C1)C2=CC=CC=C2)SCC3=CC=CC=C3

InChI

InChI=1S/C18H16N2O2S/c1-22-16-12-19-20(15-10-6-3-7-11-15)18(21)17(16)23-13-14-8-4-2-5-9-14/h2-12H,13H2,1H3