4-(2-chlorophenyl)-6-(2-methylprop-2-enylsulfanyl)-2-oxidanyl-3-thiophen-2-ylcarbonyl-2-(trifluoromethyl)-3,4-dihydro-1H-pyridine-5-carbonitrile

Systemtic Name: 4-(2-chlorophenyl)-6-(2-methylprop-2-enylsulfanyl)-2-oxidanyl-3-thiophen-2-ylcarbonyl-2-(trifluoromethyl)-3,4-dihydro-1H-pyridine-5-carbonitrile Openeye Name: 4-(2-chlorophenyl)-2-hydroxy-6-(2-methylallylsulfanyl)-3-(thiophene-2-carbonyl)-2-(trifluoromethyl)-3,4-dihydro-1H-pyridine-5-carbonitrile CAS Name: 4-(2-chlorophenyl)-2-hydroxy-6-(2-methylprop-2-enylthio)-3-[oxo(thiophen-2-yl)methyl]-2-(trifluoromethyl)-3,4-dihydro-1H-pyridine-5-carbonitrile IUPAC Name: 4-(2-chlorophenyl)-2-hydroxy-6-(2-methylprop-2-enylsulfanyl)-3-(thiophene-2-carbonyl)-2-(trifluoromethyl)-3,4-dihydro-1H-pyridine-5-carbonitrile Traditional Name: 4-(2-chlorophenyl)-2-hydroxy-6-(2-methylallylthio)-3-(2-thenoyl)-2-(trifluoromethyl)-3,4-dihydro-1H-pyridine-5-carbonitrile Formula: C22H18ClF3N2O2S2 MolecularWeight: 498.96873

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)CSC1=C(C(C(C(N1)(C(F)(F)F)O)C(=O)C2=CC=CS2)C3=CC=CC=C3Cl)C#N

Isomeric SMILES

CC(=C)CSC1=C(C(C(C(N1)(C(F)(F)F)O)C(=O)C2=CC=CS2)C3=CC=CC=C3Cl)C#N

InChI

InChI=1S/C22H18ClF3N2O2S2/c1-12(2)11-32-20-14(10-27)17(13-6-3-4-7-15(13)23)18(19(29)16-8-5-9-31-16)21(30,28-20)22(24,25)26/h3-9,17-18,28,30H,1,11H2,2H3