2-[(4-tert-butylphenyl)sulfinylmethylsulfanyl]-6-(4-methylphenyl)-4-phenyl-pyridine-3-carbonitrile

Systemtic Name: 2-[(4-tert-butylphenyl)sulfinylmethylsulfanyl]-6-(4-methylphenyl)-4-phenyl-pyridine-3-carbonitrile Openeye Name: 2-[(4-tert-butylphenyl)sulfinylmethylsulfanyl]-4-phenyl-6-(p-tolyl)pyridine-3-carbonitrile CAS Name: 2-[(4-tert-butylphenyl)sulfinylmethylthio]-6-(4-methylphenyl)-4-phenyl-3-pyridinecarbonitrile IUPAC Name: 2-[(4-tert-butylphenyl)sulfinylmethylsulfanyl]-6-(4-methylphenyl)-4-phenylpyridine-3-carbonitrile Traditional Name: 2-[(4-tert-butylphenyl)sulfinylmethylthio]-4-phenyl-6-(p-tolyl)nicotinonitrile Formula: C30H28N2OS2 MolecularWeight: 496.68612

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=C(C(=C2)C3=CC=CC=C3)C#N)SCS(=O)C4=CC=C(C=C4)C(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=C(C(=C2)C3=CC=CC=C3)C#N)SCS(=O)C4=CC=C(C=C4)C(C)(C)C

InChI

InChI=1S/C30H28N2OS2/c1-21-10-12-23(13-11-21)28-18-26(22-8-6-5-7-9-22)27(19-31)29(32-28)34-20-35(33)25-16-14-24(15-17-25)30(2,3)4/h5-18H,20H2,1-4H3