N-[(4-chlorophenyl)methyl]-4-[[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methyl]benzamide

Systemtic Name: N-[(4-chlorophenyl)methyl]-4-[[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methyl]benzamide Openeye Name: N-[(4-chlorophenyl)methyl]-4-[[4-(p-tolylsulfonyl)piperazin-1-yl]methyl]benzamide CAS Name: N-[(4-chlorophenyl)methyl]-4-[[4-(4-methylphenyl)sulfonyl-1-piperazinyl]methyl]benzamide IUPAC Name: N-[(4-chlorophenyl)methyl]-4-[[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methyl]benzamide Traditional Name: N-(4-chlorobenzyl)-4-[(4-tosylpiperazino)methyl]benzamide Formula: C26H28ClN3O3S MolecularWeight: 498.03682

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=CC=C(C=C3)C(=O)NCC4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=CC=C(C=C3)C(=O)NCC4=CC=C(C=C4)Cl

InChI

InChI=1S/C26H28ClN3O3S/c1-20-2-12-25(13-3-20)34(32,33)30-16-14-29(15-17-30)19-22-4-8-23(9-5-22)26(31)28-18-21-6-10-24(27)11-7-21/h2-13H,14-19H2,1H3,(H,28,31)