4-[2-(2-methylsulfonylpyridin-3-yl)cyclopenten-1-yl]benzenecarbonitrile

Systemtic Name: 4-[2-(2-methylsulfonylpyridin-3-yl)cyclopenten-1-yl]benzenecarbonitrile Openeye Name: 4-[2-(2-methylsulfonyl-3-pyridyl)cyclopenten-1-yl]benzonitrile CAS Name: 4-[2-(2-methylsulfonyl-3-pyridinyl)-1-cyclopentenyl]benzonitrile IUPAC Name: 4-[2-(2-methylsulfonylpyridin-3-yl)cyclopenten-1-yl]benzonitrile Traditional Name: 4-[2-(2-mesyl-3-pyridyl)cyclopenten-1-yl]benzonitrile Formula: C18H16N2O2S MolecularWeight: 324.39684

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=C(C=CC=N1)C2=C(CCC2)C3=CC=C(C=C3)C#N

Isomeric SMILES

CS(=O)(=O)C1=C(C=CC=N1)C2=C(CCC2)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C18H16N2O2S/c1-23(21,22)18-17(6-3-11-20-18)16-5-2-4-15(16)14-9-7-13(12-19)8-10-14/h3,6-11H,2,4-5H2,1H3