2-[(4-tert-butylphenyl)sulfinylmethylsulfanyl]-4,6-diphenyl-pyridine-3-carbonitrile

Systemtic Name: 2-[(4-tert-butylphenyl)sulfinylmethylsulfanyl]-4,6-diphenyl-pyridine-3-carbonitrile Openeye Name: 2-[(4-tert-butylphenyl)sulfinylmethylsulfanyl]-4,6-diphenyl-pyridine-3-carbonitrile CAS Name: 2-[(4-tert-butylphenyl)sulfinylmethylthio]-4,6-diphenyl-3-pyridinecarbonitrile IUPAC Name: 2-[(4-tert-butylphenyl)sulfinylmethylsulfanyl]-4,6-diphenylpyridine-3-carbonitrile Traditional Name: 2-[(4-tert-butylphenyl)sulfinylmethylthio]-4,6-diphenyl-nicotinonitrile Formula: C29H26N2OS2 MolecularWeight: 482.65954

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)S(=O)CSC2=C(C(=CC(=N2)C3=CC=CC=C3)C4=CC=CC=C4)C#N

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)S(=O)CSC2=C(C(=CC(=N2)C3=CC=CC=C3)C4=CC=CC=C4)C#N

InChI

InChI=1S/C29H26N2OS2/c1-29(2,3)23-14-16-24(17-15-23)34(32)20-33-28-26(19-30)25(21-10-6-4-7-11-21)18-27(31-28)22-12-8-5-9-13-22/h4-18H,20H2,1-3H3