2-[3-(4-methylphenyl)-3-oxidanylidene-propyl]sulfanyl-6-thiophen-2-yl-4-(trifluoromethyl)pyridine-3-carbonitrile

Systemtic Name: 2-[3-(4-methylphenyl)-3-oxidanylidene-propyl]sulfanyl-6-thiophen-2-yl-4-(trifluoromethyl)pyridine-3-carbonitrile Openeye Name: 2-[3-oxo-3-(p-tolyl)propyl]sulfanyl-6-(2-thienyl)-4-(trifluoromethyl)pyridine-3-carbonitrile CAS Name: 2-[[3-(4-methylphenyl)-3-oxopropyl]thio]-6-thiophen-2-yl-4-(trifluoromethyl)-3-pyridinecarbonitrile IUPAC Name: 2-[3-(4-methylphenyl)-3-oxopropyl]sulfanyl-6-thiophen-2-yl-4-(trifluoromethyl)pyridine-3-carbonitrile Traditional Name: 2-[[3-keto-3-(p-tolyl)propyl]thio]-6-(2-thienyl)-4-(trifluoromethyl)nicotinonitrile Formula: C21H15F3N2OS2 MolecularWeight: 432.48181

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)CCSC2=C(C(=CC(=N2)C3=CC=CS3)C(F)(F)F)C#N

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)CCSC2=C(C(=CC(=N2)C3=CC=CS3)C(F)(F)F)C#N

InChI

InChI=1S/C21H15F3N2OS2/c1-13-4-6-14(7-5-13)18(27)8-10-29-20-15(12-25)16(21(22,23)24)11-17(26-20)19-3-2-9-28-19/h2-7,9,11H,8,10H2,1H3