4-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)-2-sulfanyl-6-(trifluoromethyl)-1H-pyridine-3-carbonitrile

Systemtic Name: 4-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)-2-sulfanyl-6-(trifluoromethyl)-1H-pyridine-3-carbonitrile Openeye Name: 4-(4-oxocyclohexa-2,5-dien-1-ylidene)-2-sulfanyl-6-(trifluoromethyl)-1H-pyridine-3-carbonitrile CAS Name: 2-mercapto-4-(4-oxo-1-cyclohexa-2,5-dienylidene)-6-(trifluoromethyl)-1H-pyridine-3-carbonitrile IUPAC Name: 4-(4-oxocyclohexa-2,5-dien-1-ylidene)-2-sulfanyl-6-(trifluoromethyl)-1H-pyridine-3-carbonitrile Traditional Name: 4-(4-ketocyclohexa-2,5-dien-1-ylidene)-2-mercapto-6-(trifluoromethyl)-1H-pyridine-3-carbonitrile Formula: C13H7F3N2OS MolecularWeight: 296.26769

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=O)C=CC1=C2C=C(NC(=C2C#N)S)C(F)(F)F

Isomeric SMILES

C1=CC(=O)C=CC1=C2C=C(NC(=C2C#N)S)C(F)(F)F

InChI

InChI=1S/C13H7F3N2OS/c14-13(15,16)11-5-9(10(6-17)12(20)18-11)7-1-3-8(19)4-2-7/h1-5,18,20H