4-methylsulfanyl-6-oxidanylidene-1-[3-(trifluoromethyl)phenyl]pyridazine-3-carbonitrile

Systemtic Name: 4-methylsulfanyl-6-oxidanylidene-1-[3-(trifluoromethyl)phenyl]pyridazine-3-carbonitrile Openeye Name: 4-methylsulfanyl-6-oxo-1-[3-(trifluoromethyl)phenyl]pyridazine-3-carbonitrile CAS Name: 4-(methylthio)-6-oxo-1-[3-(trifluoromethyl)phenyl]-3-pyridazinecarbonitrile IUPAC Name: 4-methylsulfanyl-6-oxo-1-[3-(trifluoromethyl)phenyl]pyridazine-3-carbonitrile Traditional Name: 6-keto-4-(methylthio)-1-[3-(trifluoromethyl)phenyl]pyridazine-3-carbonitrile Formula: C13H8F3N3OS MolecularWeight: 311.28233

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC(=O)N(N=C1C#N)C2=CC=CC(=C2)C(F)(F)F

Isomeric SMILES

CSC1=CC(=O)N(N=C1C#N)C2=CC=CC(=C2)C(F)(F)F

InChI

InChI=1S/C13H8F3N3OS/c1-21-11-6-12(20)19(18-10(11)7-17)9-4-2-3-8(5-9)13(14,15)16/h2-6H,1H3