4-(3,4-dimethoxyphenyl)-6-(4-fluorophenyl)-2-(4-methylphenyl)sulfanyl-pyridine-3-carbonitrile

Systemtic Name: 4-(3,4-dimethoxyphenyl)-6-(4-fluorophenyl)-2-(4-methylphenyl)sulfanyl-pyridine-3-carbonitrile Openeye Name: 4-(3,4-dimethoxyphenyl)-6-(4-fluorophenyl)-2-(p-tolylsulfanyl)pyridine-3-carbonitrile CAS Name: 4-(3,4-dimethoxyphenyl)-6-(4-fluorophenyl)-2-[(4-methylphenyl)thio]-3-pyridinecarbonitrile IUPAC Name: 4-(3,4-dimethoxyphenyl)-6-(4-fluorophenyl)-2-(4-methylphenyl)sulfanylpyridine-3-carbonitrile Traditional Name: 4-(3,4-dimethoxyphenyl)-6-(4-fluorophenyl)-2-(p-tolylthio)nicotinonitrile Formula: C27H21FN2O2S MolecularWeight: 456.531243

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2=C(C(=CC(=N2)C3=CC=C(C=C3)F)C4=CC(=C(C=C4)OC)OC)C#N

Isomeric SMILES

CC1=CC=C(C=C1)SC2=C(C(=CC(=N2)C3=CC=C(C=C3)F)C4=CC(=C(C=C4)OC)OC)C#N

InChI

InChI=1S/C27H21FN2O2S/c1-17-4-11-21(12-5-17)33-27-23(16-29)22(19-8-13-25(31-2)26(14-19)32-3)15-24(30-27)18-6-9-20(28)10-7-18/h4-15H,1-3H3