N-(4-phenylbutan-2-yl)-4-[[4-(phenylsulfonyl)piperazin-1-yl]methyl]benzamide

Systemtic Name: N-(4-phenylbutan-2-yl)-4-[[4-(phenylsulfonyl)piperazin-1-yl]methyl]benzamide Openeye Name: 4-[[4-(benzenesulfonyl)piperazin-1-yl]methyl]-N-(1-methyl-3-phenyl-propyl)benzamide CAS Name: 4-[[4-(benzenesulfonyl)-1-piperazinyl]methyl]-N-(4-phenylbutan-2-yl)benzamide IUPAC Name: 4-[[4-(benzenesulfonyl)piperazin-1-yl]methyl]-N-(4-phenylbutan-2-yl)benzamide Traditional Name: 4-[(4-besylpiperazino)methyl]-N-(1-methyl-3-phenyl-propyl)benzamide Formula: C28H33N3O3S MolecularWeight: 491.64492

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=CC=C1)NC(=O)C2=CC=C(C=C2)CN3CCN(CC3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CC(CCC1=CC=CC=C1)NC(=O)C2=CC=C(C=C2)CN3CCN(CC3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C28H33N3O3S/c1-23(12-13-24-8-4-2-5-9-24)29-28(32)26-16-14-25(15-17-26)22-30-18-20-31(21-19-30)35(33,34)27-10-6-3-7-11-27/h2-11,14-17,23H,12-13,18-22H2,1H3,(H,29,32)