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

Systemtic Name: 2-[(4-tert-butylphenyl)methylsulfanyl]-4-(4-chlorophenyl)-6-(4-methoxyphenyl)pyridine-3-carbonitrile Openeye Name: 2-[(4-tert-butylphenyl)methylsulfanyl]-4-(4-chlorophenyl)-6-(4-methoxyphenyl)pyridine-3-carbonitrile CAS Name: 2-[(4-tert-butylphenyl)methylthio]-4-(4-chlorophenyl)-6-(4-methoxyphenyl)-3-pyridinecarbonitrile IUPAC Name: 2-[(4-tert-butylphenyl)methylsulfanyl]-4-(4-chlorophenyl)-6-(4-methoxyphenyl)pyridine-3-carbonitrile Traditional Name: 2-[(4-tert-butylbenzyl)thio]-4-(4-chlorophenyl)-6-(4-methoxyphenyl)nicotinonitrile Formula: C30H27ClN2OS MolecularWeight: 499.06618

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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=C(C=C4)Cl)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=C(C=C4)Cl)C#N

InChI

InChI=1S/C30H27ClN2OS/c1-30(2,3)23-11-5-20(6-12-23)19-35-29-27(18-32)26(21-7-13-24(31)14-8-21)17-28(33-29)22-9-15-25(34-4)16-10-22/h5-17H,19H2,1-4H3