6-(3-methyl-1-benzothiophen-2-yl)-2-oxidanylidene-1-(phenylmethyl)-4-(trifluoromethyl)pyridine-3-carbonitrile

Systemtic Name: 6-(3-methyl-1-benzothiophen-2-yl)-2-oxidanylidene-1-(phenylmethyl)-4-(trifluoromethyl)pyridine-3-carbonitrile Openeye Name: 1-benzyl-6-(3-methylbenzothiophen-2-yl)-2-oxo-4-(trifluoromethyl)pyridine-3-carbonitrile CAS Name: 6-(3-methyl-1-benzothiophen-2-yl)-2-oxo-1-(phenylmethyl)-4-(trifluoromethyl)-3-pyridinecarbonitrile IUPAC Name: 1-benzyl-6-(3-methyl-1-benzothiophen-2-yl)-2-oxo-4-(trifluoromethyl)pyridine-3-carbonitrile Traditional Name: 1-benzyl-2-keto-6-(3-methylbenzothiophen-2-yl)-4-(trifluoromethyl)nicotinonitrile Formula: C23H15F3N2OS MolecularWeight: 424.43821

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=CC=CC=C12)C3=CC(=C(C(=O)N3CC4=CC=CC=C4)C#N)C(F)(F)F

Isomeric SMILES

CC1=C(SC2=CC=CC=C12)C3=CC(=C(C(=O)N3CC4=CC=CC=C4)C#N)C(F)(F)F

InChI

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