4-[4-[1-[2-(4-dimethylaminophenyl)ethyl]piperidin-4-yl]sulfonylphenyl]benzenecarbonitrile

Systemtic Name: 4-[4-[1-[2-(4-dimethylaminophenyl)ethyl]piperidin-4-yl]sulfonylphenyl]benzenecarbonitrile Openeye Name: 4-[4-[[1-[2-(4-dimethylaminophenyl)ethyl]-4-piperidyl]sulfonyl]phenyl]benzonitrile CAS Name: 4-[4-[[1-[2-(4-dimethylaminophenyl)ethyl]-4-piperidinyl]sulfonyl]phenyl]benzonitrile IUPAC Name: 4-[4-[1-[2-(4-dimethylaminophenyl)ethyl]piperidin-4-yl]sulfonylphenyl]benzonitrile Traditional Name: 4-[4-[[1-[2-(4-dimethylaminophenyl)ethyl]-4-piperidyl]sulfonyl]phenyl]benzonitrile Formula: C28H31N3O2S MolecularWeight: 473.62964

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)CCN2CCC(CC2)S(=O)(=O)C3=CC=C(C=C3)C4=CC=C(C=C4)C#N

Isomeric SMILES

CN(C)C1=CC=C(C=C1)CCN2CCC(CC2)S(=O)(=O)C3=CC=C(C=C3)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C28H31N3O2S/c1-30(2)26-11-5-22(6-12-26)15-18-31-19-16-28(17-20-31)34(32,33)27-13-9-25(10-14-27)24-7-3-23(21-29)4-8-24/h3-14,28H,15-20H2,1-2H3