3-(4-propan-2-ylsulfanylphenyl)sulfanyl-1H-pyridazin-6-one

Systemtic Name: 3-(4-propan-2-ylsulfanylphenyl)sulfanyl-1H-pyridazin-6-one Openeye Name: 3-(4-isopropylsulfanylphenyl)sulfanyl-1H-pyridazin-6-one CAS Name: 3-[[4-(propan-2-ylthio)phenyl]thio]-1H-pyridazin-6-one IUPAC Name: 3-(4-propan-2-ylsulfanylphenyl)sulfanyl-1H-pyridazin-6-one Traditional Name: 3-[[4-(isopropylthio)phenyl]thio]-1H-pyridazin-6-one Formula: C13H14N2OS2 MolecularWeight: 278.39306

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC1=CC=C(C=C1)SC2=NNC(=O)C=C2

Isomeric SMILES

CC(C)SC1=CC=C(C=C1)SC2=NNC(=O)C=C2

InChI

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