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

Systemtic Name: N-[(4-fluorophenyl)methyl]-4-[[4-(phenylsulfonyl)piperazin-1-yl]methyl]benzamide Openeye Name: 4-[[4-(benzenesulfonyl)piperazin-1-yl]methyl]-N-[(4-fluorophenyl)methyl]benzamide CAS Name: 4-[[4-(benzenesulfonyl)-1-piperazinyl]methyl]-N-[(4-fluorophenyl)methyl]benzamide IUPAC Name: 4-[[4-(benzenesulfonyl)piperazin-1-yl]methyl]-N-[(4-fluorophenyl)methyl]benzamide Traditional Name: 4-[(4-besylpiperazino)methyl]-N-(4-fluorobenzyl)benzamide Formula: C25H26FN3O3S MolecularWeight: 467.555643

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H26FN3O3S/c26-23-12-8-20(9-13-23)18-27-25(30)22-10-6-21(7-11-22)19-28-14-16-29(17-15-28)33(31,32)24-4-2-1-3-5-24/h1-13H,14-19H2,(H,27,30)