6-(4-bromophenyl)-2-[2-(4-tert-butylphenyl)sulfinylethylsulfanyl]-4-phenyl-pyridine-3-carbonitrile

Systemtic Name: 6-(4-bromophenyl)-2-[2-(4-tert-butylphenyl)sulfinylethylsulfanyl]-4-phenyl-pyridine-3-carbonitrile Openeye Name: 6-(4-bromophenyl)-2-[2-(4-tert-butylphenyl)sulfinylethylsulfanyl]-4-phenyl-pyridine-3-carbonitrile CAS Name: 6-(4-bromophenyl)-2-[2-(4-tert-butylphenyl)sulfinylethylthio]-4-phenyl-3-pyridinecarbonitrile IUPAC Name: 6-(4-bromophenyl)-2-[2-(4-tert-butylphenyl)sulfinylethylsulfanyl]-4-phenylpyridine-3-carbonitrile Traditional Name: 6-(4-bromophenyl)-2-[2-(4-tert-butylphenyl)sulfinylethylthio]-4-phenyl-nicotinonitrile Formula: C30H27BrN2OS2 MolecularWeight: 575.58218

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)S(=O)CCSC2=C(C(=CC(=N2)C3=CC=C(C=C3)Br)C4=CC=CC=C4)C#N

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)S(=O)CCSC2=C(C(=CC(=N2)C3=CC=C(C=C3)Br)C4=CC=CC=C4)C#N

InChI

InChI=1S/C30H27BrN2OS2/c1-30(2,3)23-11-15-25(16-12-23)36(34)18-17-35-29-27(20-32)26(21-7-5-4-6-8-21)19-28(33-29)22-9-13-24(31)14-10-22/h4-16,19H,17-18H2,1-3H3