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

Systemtic Name: 2-[2-[(4-chlorophenyl)methylsulfinyl]ethylsulfanyl]-6-(4-methoxyphenyl)-4-phenyl-pyridine-3-carbonitrile Openeye Name: 2-[2-[(4-chlorophenyl)methylsulfinyl]ethylsulfanyl]-6-(4-methoxyphenyl)-4-phenyl-pyridine-3-carbonitrile CAS Name: 2-[2-[(4-chlorophenyl)methylsulfinyl]ethylthio]-6-(4-methoxyphenyl)-4-phenyl-3-pyridinecarbonitrile IUPAC Name: 2-[2-[(4-chlorophenyl)methylsulfinyl]ethylsulfanyl]-6-(4-methoxyphenyl)-4-phenylpyridine-3-carbonitrile Traditional Name: 2-[2-(4-chlorobenzyl)sulfinylethylthio]-6-(4-methoxyphenyl)-4-phenyl-nicotinonitrile Formula: C28H23ClN2O2S2 MolecularWeight: 519.07742

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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)SCCS(=O)CC4=CC=C(C=C4)Cl

Isomeric SMILES

COC1=CC=C(C=C1)C2=NC(=C(C(=C2)C3=CC=CC=C3)C#N)SCCS(=O)CC4=CC=C(C=C4)Cl

InChI

InChI=1S/C28H23ClN2O2S2/c1-33-24-13-9-22(10-14-24)27-17-25(21-5-3-2-4-6-21)26(18-30)28(31-27)34-15-16-35(32)19-20-7-11-23(29)12-8-20/h2-14,17H,15-16,19H2,1H3