2-[(4-cyanophenyl)methylsulfanyl]-4-(4-methoxyphenyl)-6-thiophen-2-yl-pyridine-3-carbonitrile

Systemtic Name: 2-[(4-cyanophenyl)methylsulfanyl]-4-(4-methoxyphenyl)-6-thiophen-2-yl-pyridine-3-carbonitrile Openeye Name: 2-[(4-cyanophenyl)methylsulfanyl]-4-(4-methoxyphenyl)-6-(2-thienyl)pyridine-3-carbonitrile CAS Name: 2-[(4-cyanophenyl)methylthio]-4-(4-methoxyphenyl)-6-thiophen-2-yl-3-pyridinecarbonitrile IUPAC Name: 2-[(4-cyanophenyl)methylsulfanyl]-4-(4-methoxyphenyl)-6-thiophen-2-ylpyridine-3-carbonitrile Traditional Name: 2-[(4-cyanobenzyl)thio]-4-(4-methoxyphenyl)-6-(2-thienyl)nicotinonitrile Formula: C25H17N3OS2 MolecularWeight: 439.55198

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CC(=NC(=C2C#N)SCC3=CC=C(C=C3)C#N)C4=CC=CS4

Isomeric SMILES

COC1=CC=C(C=C1)C2=CC(=NC(=C2C#N)SCC3=CC=C(C=C3)C#N)C4=CC=CS4

InChI

InChI=1S/C25H17N3OS2/c1-29-20-10-8-19(9-11-20)21-13-23(24-3-2-12-30-24)28-25(22(21)15-27)31-16-18-6-4-17(14-26)5-7-18/h2-13H,16H2,1H3