N-(4-chloranyl-2,5-dimethoxy-phenyl)-4-[[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methyl]benzamide

Systemtic Name: N-(4-chloranyl-2,5-dimethoxy-phenyl)-4-[[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methyl]benzamide Openeye Name: N-(4-chloro-2,5-dimethoxy-phenyl)-4-[[4-(p-tolylsulfonyl)piperazin-1-yl]methyl]benzamide CAS Name: N-(4-chloro-2,5-dimethoxyphenyl)-4-[[4-(4-methylphenyl)sulfonyl-1-piperazinyl]methyl]benzamide IUPAC Name: N-(4-chloro-2,5-dimethoxyphenyl)-4-[[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methyl]benzamide Traditional Name: N-(4-chloro-2,5-dimethoxy-phenyl)-4-[(4-tosylpiperazino)methyl]benzamide Formula: C27H30ClN3O5S MolecularWeight: 544.0622

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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=CC(=C(C=C4OC)Cl)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=CC=C(C=C3)C(=O)NC4=CC(=C(C=C4OC)Cl)OC

InChI

InChI=1S/C27H30ClN3O5S/c1-19-4-10-22(11-5-19)37(33,34)31-14-12-30(13-15-31)18-20-6-8-21(9-7-20)27(32)29-24-17-25(35-2)23(28)16-26(24)36-3/h4-11,16-17H,12-15,18H2,1-3H3,(H,29,32)