4-[2-(6-methylsulfonylpyridin-3-yl)cyclopenten-1-yl]benzenecarbonitrile

Systemtic Name: 4-[2-(6-methylsulfonylpyridin-3-yl)cyclopenten-1-yl]benzenecarbonitrile Openeye Name: 4-[2-(6-methylsulfonyl-3-pyridyl)cyclopenten-1-yl]benzonitrile CAS Name: 4-[2-(6-methylsulfonyl-3-pyridinyl)-1-cyclopentenyl]benzonitrile IUPAC Name: 4-[2-(6-methylsulfonylpyridin-3-yl)cyclopenten-1-yl]benzonitrile Traditional Name: 4-[2-(6-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=NC=C(C=C1)C2=C(CCC2)C3=CC=C(C=C3)C#N

Isomeric SMILES

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

InChI

InChI=1S/C18H16N2O2S/c1-23(21,22)18-10-9-15(12-20-18)17-4-2-3-16(17)14-7-5-13(11-19)6-8-14/h5-10,12H,2-4H2,1H3