N-(4-phenylmethoxyphenyl)-3-[[4-(phenylsulfonyl)piperazin-1-yl]methyl]benzamide

Systemtic Name: N-(4-phenylmethoxyphenyl)-3-[[4-(phenylsulfonyl)piperazin-1-yl]methyl]benzamide Openeye Name: 3-[[4-(benzenesulfonyl)piperazin-1-yl]methyl]-N-(4-benzyloxyphenyl)benzamide CAS Name: 3-[[4-(benzenesulfonyl)-1-piperazinyl]methyl]-N-(4-phenylmethoxyphenyl)benzamide IUPAC Name: 3-[[4-(benzenesulfonyl)piperazin-1-yl]methyl]-N-(4-phenylmethoxyphenyl)benzamide Traditional Name: N-(4-benzoxyphenyl)-3-[(4-besylpiperazino)methyl]benzamide Formula: C31H31N3O4S MolecularWeight: 541.66054

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC(=C2)C(=O)NC3=CC=C(C=C3)OCC4=CC=CC=C4)S(=O)(=O)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1CC2=CC=CC(=C2)C(=O)NC3=CC=C(C=C3)OCC4=CC=CC=C4)S(=O)(=O)C5=CC=CC=C5

InChI

InChI=1S/C31H31N3O4S/c35-31(32-28-14-16-29(17-15-28)38-24-25-8-3-1-4-9-25)27-11-7-10-26(22-27)23-33-18-20-34(21-19-33)39(36,37)30-12-5-2-6-13-30/h1-17,22H,18-21,23-24H2,(H,32,35)