4-(2-chlorophenyl)-6-oxidanyl-2-sulfanylidene-5-thiophen-2-ylcarbonyl-6-(trifluoromethyl)piperidine-3-carbonitrile

Systemtic Name: 4-(2-chlorophenyl)-6-oxidanyl-2-sulfanylidene-5-thiophen-2-ylcarbonyl-6-(trifluoromethyl)piperidine-3-carbonitrile Openeye Name: 4-(2-chlorophenyl)-6-hydroxy-5-(thiophene-2-carbonyl)-2-thioxo-6-(trifluoromethyl)piperidine-3-carbonitrile CAS Name: 4-(2-chlorophenyl)-6-hydroxy-5-[oxo(thiophen-2-yl)methyl]-2-sulfanylidene-6-(trifluoromethyl)-3-piperidinecarbonitrile IUPAC Name: 4-(2-chlorophenyl)-6-hydroxy-2-sulfanylidene-5-(thiophene-2-carbonyl)-6-(trifluoromethyl)piperidine-3-carbonitrile Traditional Name: 4-(2-chlorophenyl)-6-hydroxy-5-(2-thenoyl)-2-thioxo-6-(trifluoromethyl)nipecotonitrile Formula: C18H12ClF3N2O2S2 MolecularWeight: 444.87829

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2C(C(=S)NC(C2C(=O)C3=CC=CS3)(C(F)(F)F)O)C#N)Cl

Isomeric SMILES

C1=CC=C(C(=C1)C2C(C(=S)NC(C2C(=O)C3=CC=CS3)(C(F)(F)F)O)C#N)Cl

InChI

InChI=1S/C18H12ClF3N2O2S2/c19-11-5-2-1-4-9(11)13-10(8-23)16(27)24-17(26,18(20,21)22)14(13)15(25)12-6-3-7-28-12/h1-7,10,13-14,26H,(H,24,27)