4-(4-tert-butylphenyl)-3-cyano-6-(trifluoromethyl)pyridine-2-thiolate

Systemtic Name: 4-(4-tert-butylphenyl)-3-cyano-6-(trifluoromethyl)pyridine-2-thiolate Openeye Name: 4-(4-tert-butylphenyl)-3-cyano-6-(trifluoromethyl)pyridine-2-thiolate CAS Name: 4-(4-tert-butylphenyl)-3-cyano-6-(trifluoromethyl)-2-pyridinethiolate IUPAC Name: 4-(4-tert-butylphenyl)-3-cyano-6-(trifluoromethyl)pyridine-2-thiolate Traditional Name: 4-(4-tert-butylphenyl)-3-cyano-6-(trifluoromethyl)pyridine-2-thiolate Formula: C17H14F3N2S- MolecularWeight: 335.36667

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=CC(=NC(=C2C#N)[S-])C(F)(F)F

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=CC(=NC(=C2C#N)[S-])C(F)(F)F

InChI

InChI=1S/C17H15F3N2S/c1-16(2,3)11-6-4-10(5-7-11)12-8-14(17(18,19)20)22-15(23)13(12)9-21/h4-8H,1-3H3,(H,22,23)/p-1