N-(4-chloranyl-2,5-dimethoxy-phenyl)-3-[[4-(phenylsulfonyl)piperazin-1-yl]methyl]benzamide

Systemtic Name: N-(4-chloranyl-2,5-dimethoxy-phenyl)-3-[[4-(phenylsulfonyl)piperazin-1-yl]methyl]benzamide Openeye Name: 3-[[4-(benzenesulfonyl)piperazin-1-yl]methyl]-N-(4-chloro-2,5-dimethoxy-phenyl)benzamide CAS Name: 3-[[4-(benzenesulfonyl)-1-piperazinyl]methyl]-N-(4-chloro-2,5-dimethoxyphenyl)benzamide IUPAC Name: 3-[[4-(benzenesulfonyl)piperazin-1-yl]methyl]-N-(4-chloro-2,5-dimethoxyphenyl)benzamide Traditional Name: 3-[(4-besylpiperazino)methyl]-N-(4-chloro-2,5-dimethoxy-phenyl)benzamide Formula: C26H28ClN3O5S MolecularWeight: 530.03562

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1NC(=O)C2=CC(=CC=C2)CN3CCN(CC3)S(=O)(=O)C4=CC=CC=C4)OC)Cl

Isomeric SMILES

COC1=CC(=C(C=C1NC(=O)C2=CC(=CC=C2)CN3CCN(CC3)S(=O)(=O)C4=CC=CC=C4)OC)Cl

InChI

InChI=1S/C26H28ClN3O5S/c1-34-24-17-23(25(35-2)16-22(24)27)28-26(31)20-8-6-7-19(15-20)18-29-11-13-30(14-12-29)36(32,33)21-9-4-3-5-10-21/h3-10,15-17H,11-14,18H2,1-2H3,(H,28,31)