N-(4-chloranyl-2-methyl-phenyl)-4-[[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methyl]benzamide

Systemtic Name: N-(4-chloranyl-2-methyl-phenyl)-4-[[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methyl]benzamide Openeye Name: N-(4-chloro-2-methyl-phenyl)-4-[[4-(p-tolylsulfonyl)piperazin-1-yl]methyl]benzamide CAS Name: N-(4-chloro-2-methylphenyl)-4-[[4-(4-methylphenyl)sulfonyl-1-piperazinyl]methyl]benzamide IUPAC Name: N-(4-chloro-2-methylphenyl)-4-[[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methyl]benzamide Traditional Name: N-(4-chloro-2-methyl-phenyl)-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)NC4=C(C=C(C=C4)Cl)C

Isomeric SMILES

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

InChI

InChI=1S/C26H28ClN3O3S/c1-19-3-10-24(11-4-19)34(32,33)30-15-13-29(14-16-30)18-21-5-7-22(8-6-21)26(31)28-25-12-9-23(27)17-20(25)2/h3-12,17H,13-16,18H2,1-2H3,(H,28,31)