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

Systemtic Name: N-(3-chloranyl-4-methoxy-phenyl)-4-[[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methyl]benzamide Openeye Name: N-(3-chloro-4-methoxy-phenyl)-4-[[4-(p-tolylsulfonyl)piperazin-1-yl]methyl]benzamide CAS Name: N-(3-chloro-4-methoxyphenyl)-4-[[4-(4-methylphenyl)sulfonyl-1-piperazinyl]methyl]benzamide IUPAC Name: N-(3-chloro-4-methoxyphenyl)-4-[[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methyl]benzamide Traditional Name: N-(3-chloro-4-methoxy-phenyl)-4-[(4-tosylpiperazino)methyl]benzamide Formula: C26H28ClN3O4S MolecularWeight: 514.03622

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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=C4)OC)Cl

Isomeric SMILES

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

InChI

InChI=1S/C26H28ClN3O4S/c1-19-3-10-23(11-4-19)35(32,33)30-15-13-29(14-16-30)18-20-5-7-21(8-6-20)26(31)28-22-9-12-25(34-2)24(27)17-22/h3-12,17H,13-16,18H2,1-2H3,(H,28,31)