N-[(4-chlorophenyl)methyl]-3-[[4-(phenylsulfonyl)piperazin-1-yl]methyl]benzamide

Systemtic Name: N-[(4-chlorophenyl)methyl]-3-[[4-(phenylsulfonyl)piperazin-1-yl]methyl]benzamide Openeye Name: 3-[[4-(benzenesulfonyl)piperazin-1-yl]methyl]-N-[(4-chlorophenyl)methyl]benzamide CAS Name: 3-[[4-(benzenesulfonyl)-1-piperazinyl]methyl]-N-[(4-chlorophenyl)methyl]benzamide IUPAC Name: 3-[[4-(benzenesulfonyl)piperazin-1-yl]methyl]-N-[(4-chlorophenyl)methyl]benzamide Traditional Name: 3-[(4-besylpiperazino)methyl]-N-(4-chlorobenzyl)benzamide Formula: C25H26ClN3O3S MolecularWeight: 484.01024

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC(=C2)C(=O)NCC3=CC=C(C=C3)Cl)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1CC2=CC=CC(=C2)C(=O)NCC3=CC=C(C=C3)Cl)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C25H26ClN3O3S/c26-23-11-9-20(10-12-23)18-27-25(30)22-6-4-5-21(17-22)19-28-13-15-29(16-14-28)33(31,32)24-7-2-1-3-8-24/h1-12,17H,13-16,18-19H2,(H,27,30)