4-chloranyl-N-[2-[4-(2-cyanoethyl)piperazin-1-yl]-2-phenyl-ethyl]benzenesulfonamide

Systemtic Name: 4-chloranyl-N-[2-[4-(2-cyanoethyl)piperazin-1-yl]-2-phenyl-ethyl]benzenesulfonamide Openeye Name: 4-chloro-N-[2-[4-(2-cyanoethyl)piperazin-1-yl]-2-phenyl-ethyl]benzenesulfonamide CAS Name: 4-chloro-N-[2-[4-(2-cyanoethyl)-1-piperazinyl]-2-phenylethyl]benzenesulfonamide IUPAC Name: 4-chloro-N-[2-[4-(2-cyanoethyl)piperazin-1-yl]-2-phenylethyl]benzenesulfonamide Traditional Name: 4-chloro-N-[2-[4-(2-cyanoethyl)piperazino]-2-phenyl-ethyl]benzenesulfonamide Formula: C21H25ClN4O2S MolecularWeight: 432.9668

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC#N)C(CNS(=O)(=O)C2=CC=C(C=C2)Cl)C3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1CCC#N)C(CNS(=O)(=O)C2=CC=C(C=C2)Cl)C3=CC=CC=C3

InChI

InChI=1S/C21H25ClN4O2S/c22-19-7-9-20(10-8-19)29(27,28)24-17-21(18-5-2-1-3-6-18)26-15-13-25(14-16-26)12-4-11-23/h1-3,5-10,21,24H,4,12-17H2