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

Systemtic Name: N-(3-chloranyl-2-methyl-phenyl)-4-[[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methyl]benzamide Openeye Name: N-(3-chloro-2-methyl-phenyl)-4-[[4-(p-tolylsulfonyl)piperazin-1-yl]methyl]benzamide CAS Name: N-(3-chloro-2-methylphenyl)-4-[[4-(4-methylphenyl)sulfonyl-1-piperazinyl]methyl]benzamide IUPAC Name: N-(3-chloro-2-methylphenyl)-4-[[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methyl]benzamide Traditional Name: N-(3-chloro-2-methyl-phenyl)-4-[(4-tosylpiperazino)methyl]benzamide Formula: C26H28ClN3O3S MolecularWeight: 498.03682

Click to see the large picture

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(=CC=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(=CC=C4)Cl)C

InChI

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