5-chloranyl-2-methyl-4-(phenylmethylsulfanyl)pyridazin-3-one

Systemtic Name: 5-chloranyl-2-methyl-4-(phenylmethylsulfanyl)pyridazin-3-one Openeye Name: 4-benzylsulfanyl-5-chloro-2-methyl-pyridazin-3-one CAS Name: 5-chloro-2-methyl-4-(phenylmethylthio)-3-pyridazinone IUPAC Name: 4-benzylsulfanyl-5-chloro-2-methylpyridazin-3-one Traditional Name: 4-(benzylthio)-5-chloro-2-methyl-pyridazin-3-one Formula: C12H11ClN2OS MolecularWeight: 266.74654

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C(=C(C=N1)Cl)SCC2=CC=CC=C2

Isomeric SMILES

CN1C(=O)C(=C(C=N1)Cl)SCC2=CC=CC=C2

InChI

InChI=1S/C12H11ClN2OS/c1-15-12(16)11(10(13)7-14-15)17-8-9-5-3-2-4-6-9/h2-7H,8H2,1H3