2-[2-(4-chlorophenyl)sulfonylethylsulfanyl]-4,6-dimethyl-pyridine-3-carbonitrile

Systemtic Name: 2-[2-(4-chlorophenyl)sulfonylethylsulfanyl]-4,6-dimethyl-pyridine-3-carbonitrile Openeye Name: 2-[2-(4-chlorophenyl)sulfonylethylsulfanyl]-4,6-dimethyl-pyridine-3-carbonitrile CAS Name: 2-[2-(4-chlorophenyl)sulfonylethylthio]-4,6-dimethyl-3-pyridinecarbonitrile IUPAC Name: 2-[2-(4-chlorophenyl)sulfonylethylsulfanyl]-4,6-dimethylpyridine-3-carbonitrile Traditional Name: 2-[2-(4-chlorophenyl)sulfonylethylthio]-4,6-dimethyl-nicotinonitrile Formula: C16H15ClN2O2S2 MolecularWeight: 366.8855

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=C1C#N)SCCS(=O)(=O)C2=CC=C(C=C2)Cl)C

Isomeric SMILES

CC1=CC(=NC(=C1C#N)SCCS(=O)(=O)C2=CC=C(C=C2)Cl)C

InChI

InChI=1S/C16H15ClN2O2S2/c1-11-9-12(2)19-16(15(11)10-18)22-7-8-23(20,21)14-5-3-13(17)4-6-14/h3-6,9H,7-8H2,1-2H3