1-[2-(4-methylsulfonylphenyl)phenyl]carbonyl-4-phenyl-piperidine-4-carbonitrile

Systemtic Name: 1-[2-(4-methylsulfonylphenyl)phenyl]carbonyl-4-phenyl-piperidine-4-carbonitrile Openeye Name: 1-[2-(4-methylsulfonylphenyl)benzoyl]-4-phenyl-piperidine-4-carbonitrile CAS Name: 1-[[2-(4-methylsulfonylphenyl)phenyl]-oxomethyl]-4-phenyl-4-piperidinecarbonitrile IUPAC Name: 1-[2-(4-methylsulfonylphenyl)benzoyl]-4-phenylpiperidine-4-carbonitrile Traditional Name: 1-[2-(4-mesylphenyl)benzoyl]-4-phenyl-isonipecotonitrile Formula: C26H24N2O3S MolecularWeight: 444.54536

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C2=CC=CC=C2C(=O)N3CCC(CC3)(C#N)C4=CC=CC=C4

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C2=CC=CC=C2C(=O)N3CCC(CC3)(C#N)C4=CC=CC=C4

InChI

InChI=1S/C26H24N2O3S/c1-32(30,31)22-13-11-20(12-14-22)23-9-5-6-10-24(23)25(29)28-17-15-26(19-27,16-18-28)21-7-3-2-4-8-21/h2-14H,15-18H2,1H3