4,6-dimethyl-2-(3-octylsulfonyl-2-oxidanyl-propyl)sulfanyl-pyridine-3-carbonitrile

Systemtic Name: 4,6-dimethyl-2-(3-octylsulfonyl-2-oxidanyl-propyl)sulfanyl-pyridine-3-carbonitrile Openeye Name: 2-(2-hydroxy-3-octylsulfonyl-propyl)sulfanyl-4,6-dimethyl-pyridine-3-carbonitrile CAS Name: 2-[(2-hydroxy-3-octylsulfonylpropyl)thio]-4,6-dimethyl-3-pyridinecarbonitrile IUPAC Name: 2-(2-hydroxy-3-octylsulfonylpropyl)sulfanyl-4,6-dimethylpyridine-3-carbonitrile Traditional Name: 2-[(2-hydroxy-3-octylsulfonyl-propyl)thio]-4,6-dimethyl-nicotinonitrile Formula: C19H30N2O3S2 MolecularWeight: 398.5831

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCS(=O)(=O)CC(CSC1=C(C(=CC(=N1)C)C)C#N)O

Isomeric SMILES

CCCCCCCCS(=O)(=O)CC(CSC1=C(C(=CC(=N1)C)C)C#N)O

InChI

InChI=1S/C19H30N2O3S2/c1-4-5-6-7-8-9-10-26(23,24)14-17(22)13-25-19-18(12-20)15(2)11-16(3)21-19/h11,17,22H,4-10,13-14H2,1-3H3