2-[(3-methyl-5-oxidanylidene-1-phenyl-4H-pyrazol-4-yl)sulfanyl]-6-phenyl-4-(trifluoromethyl)pyridine-3-carbonitrile

Systemtic Name: 2-[(3-methyl-5-oxidanylidene-1-phenyl-4H-pyrazol-4-yl)sulfanyl]-6-phenyl-4-(trifluoromethyl)pyridine-3-carbonitrile Openeye Name: 2-[(3-methyl-5-oxo-1-phenyl-4H-pyrazol-4-yl)sulfanyl]-6-phenyl-4-(trifluoromethyl)pyridine-3-carbonitrile CAS Name: 2-[(3-methyl-5-oxo-1-phenyl-4H-pyrazol-4-yl)thio]-6-phenyl-4-(trifluoromethyl)-3-pyridinecarbonitrile IUPAC Name: 2-[(3-methyl-5-oxo-1-phenyl-4H-pyrazol-4-yl)sulfanyl]-6-phenyl-4-(trifluoromethyl)pyridine-3-carbonitrile Traditional Name: 2-[(5-keto-3-methyl-1-phenyl-2-pyrazolin-4-yl)thio]-6-phenyl-4-(trifluoromethyl)nicotinonitrile Formula: C23H15F3N4OS MolecularWeight: 452.45161

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1SC2=C(C(=CC(=N2)C3=CC=CC=C3)C(F)(F)F)C#N)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C(=O)C1SC2=C(C(=CC(=N2)C3=CC=CC=C3)C(F)(F)F)C#N)C4=CC=CC=C4

InChI

InChI=1S/C23H15F3N4OS/c1-14-20(22(31)30(29-14)16-10-6-3-7-11-16)32-21-17(13-27)18(23(24,25)26)12-19(28-21)15-8-4-2-5-9-15/h2-12,20H,1H3