2-[(4-chlorophenyl)methylsulfanylmethylsulfanyl]-6-(4-methoxyphenyl)-4-phenyl-pyridine-3-carbonitrile

Systemtic Name: 2-[(4-chlorophenyl)methylsulfanylmethylsulfanyl]-6-(4-methoxyphenyl)-4-phenyl-pyridine-3-carbonitrile Openeye Name: 2-[(4-chlorophenyl)methylsulfanylmethylsulfanyl]-6-(4-methoxyphenyl)-4-phenyl-pyridine-3-carbonitrile CAS Name: 2-[[(4-chlorophenyl)methylthio]methylthio]-6-(4-methoxyphenyl)-4-phenyl-3-pyridinecarbonitrile IUPAC Name: 2-[(4-chlorophenyl)methylsulfanylmethylsulfanyl]-6-(4-methoxyphenyl)-4-phenylpyridine-3-carbonitrile Traditional Name: 2-[[(4-chlorobenzyl)thio]methylthio]-6-(4-methoxyphenyl)-4-phenyl-nicotinonitrile Formula: C27H21ClN2OS2 MolecularWeight: 489.05144

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NC(=C(C(=C2)C3=CC=CC=C3)C#N)SCSCC4=CC=C(C=C4)Cl

Isomeric SMILES

COC1=CC=C(C=C1)C2=NC(=C(C(=C2)C3=CC=CC=C3)C#N)SCSCC4=CC=C(C=C4)Cl

InChI

InChI=1S/C27H21ClN2OS2/c1-31-23-13-9-21(10-14-23)26-15-24(20-5-3-2-4-6-20)25(16-29)27(30-26)33-18-32-17-19-7-11-22(28)12-8-19/h2-15H,17-18H2,1H3