6-(4-bromophenyl)-2-[(4-chlorophenyl)methylsulfinylmethylsulfanyl]-4-phenyl-pyridine-3-carbonitrile

Systemtic Name: 6-(4-bromophenyl)-2-[(4-chlorophenyl)methylsulfinylmethylsulfanyl]-4-phenyl-pyridine-3-carbonitrile Openeye Name: 6-(4-bromophenyl)-2-[(4-chlorophenyl)methylsulfinylmethylsulfanyl]-4-phenyl-pyridine-3-carbonitrile CAS Name: 6-(4-bromophenyl)-2-[(4-chlorophenyl)methylsulfinylmethylthio]-4-phenyl-3-pyridinecarbonitrile IUPAC Name: 6-(4-bromophenyl)-2-[(4-chlorophenyl)methylsulfinylmethylsulfanyl]-4-phenylpyridine-3-carbonitrile Traditional Name: 6-(4-bromophenyl)-2-[(4-chlorobenzyl)sulfinylmethylthio]-4-phenyl-nicotinonitrile Formula: C26H18BrClN2OS2 MolecularWeight: 553.92092

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=NC(=C2C#N)SCS(=O)CC3=CC=C(C=C3)Cl)C4=CC=C(C=C4)Br

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=NC(=C2C#N)SCS(=O)CC3=CC=C(C=C3)Cl)C4=CC=C(C=C4)Br

InChI

InChI=1S/C26H18BrClN2OS2/c27-21-10-8-20(9-11-21)25-14-23(19-4-2-1-3-5-19)24(15-29)26(30-25)32-17-33(31)16-18-6-12-22(28)13-7-18/h1-14H,16-17H2