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

Systemtic Name: 2-hexylsulfanyl-4-(2-methoxyphenyl)-6-phenyl-pyridine-3-carbonitrile Openeye Name: 2-hexylsulfanyl-4-(2-methoxyphenyl)-6-phenyl-pyridine-3-carbonitrile CAS Name: 2-(hexylthio)-4-(2-methoxyphenyl)-6-phenyl-3-pyridinecarbonitrile IUPAC Name: 2-hexylsulfanyl-4-(2-methoxyphenyl)-6-phenylpyridine-3-carbonitrile Traditional Name: 2-(hexylthio)-4-(2-methoxyphenyl)-6-phenyl-nicotinonitrile Formula: C25H26N2OS MolecularWeight: 402.55174

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCSC1=C(C(=CC(=N1)C2=CC=CC=C2)C3=CC=CC=C3OC)C#N

Isomeric SMILES

CCCCCCSC1=C(C(=CC(=N1)C2=CC=CC=C2)C3=CC=CC=C3OC)C#N

InChI

InChI=1S/C25H26N2OS/c1-3-4-5-11-16-29-25-22(18-26)21(20-14-9-10-15-24(20)28-2)17-23(27-25)19-12-7-6-8-13-19/h6-10,12-15,17H,3-5,11,16H2,1-2H3