N-(2,4-dichlorophenyl)-3-[[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methyl]benzamide

Systemtic Name: N-(2,4-dichlorophenyl)-3-[[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methyl]benzamide Openeye Name: N-(2,4-dichlorophenyl)-3-[[4-(p-tolylsulfonyl)piperazin-1-yl]methyl]benzamide CAS Name: N-(2,4-dichlorophenyl)-3-[[4-(4-methylphenyl)sulfonyl-1-piperazinyl]methyl]benzamide IUPAC Name: N-(2,4-dichlorophenyl)-3-[[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methyl]benzamide Traditional Name: N-(2,4-dichlorophenyl)-3-[(4-tosylpiperazino)methyl]benzamide Formula: C25H25Cl2N3O3S MolecularWeight: 518.4553

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=CC=CC(=C3)C(=O)NC4=C(C=C(C=C4)Cl)Cl

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=CC=CC(=C3)C(=O)NC4=C(C=C(C=C4)Cl)Cl

InChI

InChI=1S/C25H25Cl2N3O3S/c1-18-5-8-22(9-6-18)34(32,33)30-13-11-29(12-14-30)17-19-3-2-4-20(15-19)25(31)28-24-10-7-21(26)16-23(24)27/h2-10,15-16H,11-14,17H2,1H3,(H,28,31)