4-(2-chlorophenyl)-6-(4-chlorophenyl)-2-[(3-phenoxyphenyl)methylsulfanyl]pyridine-3-carbonitrile

Systemtic Name: 4-(2-chlorophenyl)-6-(4-chlorophenyl)-2-[(3-phenoxyphenyl)methylsulfanyl]pyridine-3-carbonitrile Openeye Name: 4-(2-chlorophenyl)-6-(4-chlorophenyl)-2-[(3-phenoxyphenyl)methylsulfanyl]pyridine-3-carbonitrile CAS Name: 4-(2-chlorophenyl)-6-(4-chlorophenyl)-2-[(3-phenoxyphenyl)methylthio]-3-pyridinecarbonitrile IUPAC Name: 4-(2-chlorophenyl)-6-(4-chlorophenyl)-2-[(3-phenoxyphenyl)methylsulfanyl]pyridine-3-carbonitrile Traditional Name: 4-(2-chlorophenyl)-6-(4-chlorophenyl)-2-[(3-phenoxybenzyl)thio]nicotinonitrile Formula: C31H20Cl2N2OS MolecularWeight: 539.4743

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=CC(=C2)CSC3=C(C(=CC(=N3)C4=CC=C(C=C4)Cl)C5=CC=CC=C5Cl)C#N

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=CC(=C2)CSC3=C(C(=CC(=N3)C4=CC=C(C=C4)Cl)C5=CC=CC=C5Cl)C#N

InChI

InChI=1S/C31H20Cl2N2OS/c32-23-15-13-22(14-16-23)30-18-27(26-11-4-5-12-29(26)33)28(19-34)31(35-30)37-20-21-7-6-10-25(17-21)36-24-8-2-1-3-9-24/h1-18H,20H2