4-[4-[(4-chlorophenyl)-phenyl-methyl]piperazin-1-yl]sulfonylbenzenecarbonitrile

Systemtic Name: 4-[4-[(4-chlorophenyl)-phenyl-methyl]piperazin-1-yl]sulfonylbenzenecarbonitrile Openeye Name: 4-[4-[(4-chlorophenyl)-phenyl-methyl]piperazin-1-yl]sulfonylbenzonitrile CAS Name: 4-[[4-[(4-chlorophenyl)-phenylmethyl]-1-piperazinyl]sulfonyl]benzonitrile IUPAC Name: 4-[4-[(4-chlorophenyl)-phenylmethyl]piperazin-1-yl]sulfonylbenzonitrile Traditional Name: 4-[4-[(4-chlorophenyl)-phenyl-methyl]piperazino]sulfonylbenzonitrile Formula: C24H22ClN3O2S MolecularWeight: 451.96838

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(C2=CC=CC=C2)C3=CC=C(C=C3)Cl)S(=O)(=O)C4=CC=C(C=C4)C#N

Isomeric SMILES

C1CN(CCN1C(C2=CC=CC=C2)C3=CC=C(C=C3)Cl)S(=O)(=O)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C24H22ClN3O2S/c25-22-10-8-21(9-11-22)24(20-4-2-1-3-5-20)27-14-16-28(17-15-27)31(29,30)23-12-6-19(18-26)7-13-23/h1-13,24H,14-17H2