4-(4-methoxyphenyl)-2-phenethylsulfanyl-6-phenyl-pyridine-3-carbonitrile

Systemtic Name: 4-(4-methoxyphenyl)-2-phenethylsulfanyl-6-phenyl-pyridine-3-carbonitrile Openeye Name: 4-(4-methoxyphenyl)-2-phenethylsulfanyl-6-phenyl-pyridine-3-carbonitrile CAS Name: 4-(4-methoxyphenyl)-2-(phenethylthio)-6-phenyl-3-pyridinecarbonitrile IUPAC Name: 4-(4-methoxyphenyl)-2-phenethylsulfanyl-6-phenylpyridine-3-carbonitrile Traditional Name: 4-(4-methoxyphenyl)-2-(phenethylthio)-6-phenyl-nicotinonitrile Formula: C27H22N2OS MolecularWeight: 422.54138

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CC(=NC(=C2C#N)SCCC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)C2=CC(=NC(=C2C#N)SCCC3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H22N2OS/c1-30-23-14-12-21(13-15-23)24-18-26(22-10-6-3-7-11-22)29-27(25(24)19-28)31-17-16-20-8-4-2-5-9-20/h2-15,18H,16-17H2,1H3