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

Systemtic Name: 4-(2-chlorophenyl)-2-oxidanyl-6-(phenylmethylsulfanyl)-3-thiophen-2-ylcarbonyl-2-(trifluoromethyl)-3,4-dihydro-1H-pyridine-5-carbonitrile Openeye Name: 6-benzylsulfanyl-4-(2-chlorophenyl)-2-hydroxy-3-(thiophene-2-carbonyl)-2-(trifluoromethyl)-3,4-dihydro-1H-pyridine-5-carbonitrile CAS Name: 4-(2-chlorophenyl)-2-hydroxy-3-[oxo(thiophen-2-yl)methyl]-6-(phenylmethylthio)-2-(trifluoromethyl)-3,4-dihydro-1H-pyridine-5-carbonitrile IUPAC Name: 6-benzylsulfanyl-4-(2-chlorophenyl)-2-hydroxy-3-(thiophene-2-carbonyl)-2-(trifluoromethyl)-3,4-dihydro-1H-pyridine-5-carbonitrile Traditional Name: 6-(benzylthio)-4-(2-chlorophenyl)-2-hydroxy-3-(2-thenoyl)-2-(trifluoromethyl)-3,4-dihydro-1H-pyridine-5-carbonitrile Formula: C25H18ClF3N2O2S2 MolecularWeight: 535.00083

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=C(C(C(C(N2)(C(F)(F)F)O)C(=O)C3=CC=CS3)C4=CC=CC=C4Cl)C#N

Isomeric SMILES

C1=CC=C(C=C1)CSC2=C(C(C(C(N2)(C(F)(F)F)O)C(=O)C3=CC=CS3)C4=CC=CC=C4Cl)C#N

InChI

InChI=1S/C25H18ClF3N2O2S2/c26-18-10-5-4-9-16(18)20-17(13-30)23(35-14-15-7-2-1-3-8-15)31-24(33,25(27,28)29)21(20)22(32)19-11-6-12-34-19/h1-12,20-21,31,33H,14H2