2-(2-octylsulfonylethylsulfanyl)-4,6-diphenyl-pyridine-3-carbonitrile

Systemtic Name: 2-(2-octylsulfonylethylsulfanyl)-4,6-diphenyl-pyridine-3-carbonitrile Openeye Name: 2-(2-octylsulfonylethylsulfanyl)-4,6-diphenyl-pyridine-3-carbonitrile CAS Name: 2-(2-octylsulfonylethylthio)-4,6-diphenyl-3-pyridinecarbonitrile IUPAC Name: 2-(2-octylsulfonylethylsulfanyl)-4,6-diphenylpyridine-3-carbonitrile Traditional Name: 2-(2-octylsulfonylethylthio)-4,6-diphenyl-nicotinonitrile Formula: C28H32N2O2S2 MolecularWeight: 492.69588

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCS(=O)(=O)CCSC1=C(C(=CC(=N1)C2=CC=CC=C2)C3=CC=CC=C3)C#N

Isomeric SMILES

CCCCCCCCS(=O)(=O)CCSC1=C(C(=CC(=N1)C2=CC=CC=C2)C3=CC=CC=C3)C#N

InChI

InChI=1S/C28H32N2O2S2/c1-2-3-4-5-6-13-19-34(31,32)20-18-33-28-26(22-29)25(23-14-9-7-10-15-23)21-27(30-28)24-16-11-8-12-17-24/h7-12,14-17,21H,2-6,13,18-20H2,1H3