6-(1-benzothiophen-3-yl)-1-[(4-methylphenyl)methyl]-2-oxidanylidene-4-(trifluoromethyl)pyridine-3-carbonitrile

Systemtic Name: 6-(1-benzothiophen-3-yl)-1-[(4-methylphenyl)methyl]-2-oxidanylidene-4-(trifluoromethyl)pyridine-3-carbonitrile Openeye Name: 6-(benzothiophen-3-yl)-2-oxo-1-(p-tolylmethyl)-4-(trifluoromethyl)pyridine-3-carbonitrile CAS Name: 6-(1-benzothiophen-3-yl)-1-[(4-methylphenyl)methyl]-2-oxo-4-(trifluoromethyl)-3-pyridinecarbonitrile IUPAC Name: 6-(1-benzothiophen-3-yl)-1-[(4-methylphenyl)methyl]-2-oxo-4-(trifluoromethyl)pyridine-3-carbonitrile Traditional Name: 6-(benzothiophen-3-yl)-2-keto-1-(4-methylbenzyl)-4-(trifluoromethyl)nicotinonitrile Formula: C23H15F3N2OS MolecularWeight: 424.43821

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C(=CC(=C(C2=O)C#N)C(F)(F)F)C3=CSC4=CC=CC=C43

Isomeric SMILES

CC1=CC=C(C=C1)CN2C(=CC(=C(C2=O)C#N)C(F)(F)F)C3=CSC4=CC=CC=C43

InChI

InChI=1S/C23H15F3N2OS/c1-14-6-8-15(9-7-14)12-28-20(18-13-30-21-5-3-2-4-16(18)21)10-19(23(24,25)26)17(11-27)22(28)29/h2-10,13H,12H2,1H3