N-(3-chloranyl-4-methoxy-phenyl)-4-[[4-(phenylsulfonyl)piperazin-1-yl]methyl]benzamide

Systemtic Name: N-(3-chloranyl-4-methoxy-phenyl)-4-[[4-(phenylsulfonyl)piperazin-1-yl]methyl]benzamide Openeye Name: 4-[[4-(benzenesulfonyl)piperazin-1-yl]methyl]-N-(3-chloro-4-methoxy-phenyl)benzamide CAS Name: 4-[[4-(benzenesulfonyl)-1-piperazinyl]methyl]-N-(3-chloro-4-methoxyphenyl)benzamide IUPAC Name: 4-[[4-(benzenesulfonyl)piperazin-1-yl]methyl]-N-(3-chloro-4-methoxyphenyl)benzamide Traditional Name: 4-[(4-besylpiperazino)methyl]-N-(3-chloro-4-methoxy-phenyl)benzamide Formula: C25H26ClN3O4S MolecularWeight: 500.00964

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)C2=CC=C(C=C2)CN3CCN(CC3)S(=O)(=O)C4=CC=CC=C4)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)C2=CC=C(C=C2)CN3CCN(CC3)S(=O)(=O)C4=CC=CC=C4)Cl

InChI

InChI=1S/C25H26ClN3O4S/c1-33-24-12-11-21(17-23(24)26)27-25(30)20-9-7-19(8-10-20)18-28-13-15-29(16-14-28)34(31,32)22-5-3-2-4-6-22/h2-12,17H,13-16,18H2,1H3,(H,27,30)