2-[(4-tert-butylphenyl)methylsulfanyl]-6-(4-methoxyphenyl)-4-phenyl-pyridine-3-carbonitrile

Systemtic Name: 2-[(4-tert-butylphenyl)methylsulfanyl]-6-(4-methoxyphenyl)-4-phenyl-pyridine-3-carbonitrile Openeye Name: 2-[(4-tert-butylphenyl)methylsulfanyl]-6-(4-methoxyphenyl)-4-phenyl-pyridine-3-carbonitrile CAS Name: 2-[(4-tert-butylphenyl)methylthio]-6-(4-methoxyphenyl)-4-phenyl-3-pyridinecarbonitrile IUPAC Name: 2-[(4-tert-butylphenyl)methylsulfanyl]-6-(4-methoxyphenyl)-4-phenylpyridine-3-carbonitrile Traditional Name: 2-[(4-tert-butylbenzyl)thio]-6-(4-methoxyphenyl)-4-phenyl-nicotinonitrile Formula: C30H28N2OS MolecularWeight: 464.62112

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C30H28N2OS/c1-30(2,3)24-14-10-21(11-15-24)20-34-29-27(19-31)26(22-8-6-5-7-9-22)18-28(32-29)23-12-16-25(33-4)17-13-23/h5-18H,20H2,1-4H3