N-(3-chloranyl-2-methyl-phenyl)-3-[[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methyl]benzamide

Systemtic Name: N-(3-chloranyl-2-methyl-phenyl)-3-[[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methyl]benzamide Openeye Name: N-(3-chloro-2-methyl-phenyl)-3-[[4-(p-tolylsulfonyl)piperazin-1-yl]methyl]benzamide CAS Name: N-(3-chloro-2-methylphenyl)-3-[[4-(4-methylphenyl)sulfonyl-1-piperazinyl]methyl]benzamide IUPAC Name: N-(3-chloro-2-methylphenyl)-3-[[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methyl]benzamide Traditional Name: N-(3-chloro-2-methyl-phenyl)-3-[(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=CC(=C3)C(=O)NC4=C(C(=CC=C4)Cl)C

Isomeric SMILES

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

InChI

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