5-[5-(4-methylsulfonylphenyl)cyclopenta-1,4-dien-1-yl]pyridine-2-carbonitrile

Systemtic Name: 5-[5-(4-methylsulfonylphenyl)cyclopenta-1,4-dien-1-yl]pyridine-2-carbonitrile Openeye Name: 5-[5-(4-methylsulfonylphenyl)cyclopenta-1,4-dien-1-yl]pyridine-2-carbonitrile CAS Name: 5-[5-(4-methylsulfonylphenyl)-1-cyclopenta-1,4-dienyl]-2-pyridinecarbonitrile IUPAC Name: 5-[5-(4-methylsulfonylphenyl)cyclopenta-1,4-dien-1-yl]pyridine-2-carbonitrile Traditional Name: 5-[5-(4-mesylphenyl)cyclopenta-1,4-dien-1-yl]picolinonitrile Formula: C18H14N2O2S MolecularWeight: 322.38096

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C2=CCC=C2C3=CN=C(C=C3)C#N

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C2=CCC=C2C3=CN=C(C=C3)C#N

InChI

InChI=1S/C18H14N2O2S/c1-23(21,22)16-9-6-13(7-10-16)17-3-2-4-18(17)14-5-8-15(11-19)20-12-14/h3-10,12H,2H2,1H3