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

Systemtic Name: 2-(butylsulfinylmethylsulfanyl)-4,6-diphenyl-pyridine-3-carbonitrile Openeye Name: 2-(butylsulfinylmethylsulfanyl)-4,6-diphenyl-pyridine-3-carbonitrile CAS Name: 2-(butylsulfinylmethylthio)-4,6-diphenyl-3-pyridinecarbonitrile IUPAC Name: 2-(butylsulfinylmethylsulfanyl)-4,6-diphenylpyridine-3-carbonitrile Traditional Name: 2-(butylsulfinylmethylthio)-4,6-diphenyl-nicotinonitrile Formula: C23H22N2OS2 MolecularWeight: 406.56358

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)CSC1=C(C(=CC(=N1)C2=CC=CC=C2)C3=CC=CC=C3)C#N

Isomeric SMILES

CCCCS(=O)CSC1=C(C(=CC(=N1)C2=CC=CC=C2)C3=CC=CC=C3)C#N

InChI

InChI=1S/C23H22N2OS2/c1-2-3-14-28(26)17-27-23-21(16-24)20(18-10-6-4-7-11-18)15-22(25-23)19-12-8-5-9-13-19/h4-13,15H,2-3,14,17H2,1H3