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

Systemtic Name: N-(4-methoxyphenyl)-4-[[4-(phenylsulfonyl)piperazin-1-yl]methyl]benzamide Openeye Name: 4-[[4-(benzenesulfonyl)piperazin-1-yl]methyl]-N-(4-methoxyphenyl)benzamide CAS Name: 4-[[4-(benzenesulfonyl)-1-piperazinyl]methyl]-N-(4-methoxyphenyl)benzamide IUPAC Name: 4-[[4-(benzenesulfonyl)piperazin-1-yl]methyl]-N-(4-methoxyphenyl)benzamide Traditional Name: 4-[(4-besylpiperazino)methyl]-N-(4-methoxyphenyl)benzamide Formula: C25H27N3O4S MolecularWeight: 465.56458

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H27N3O4S/c1-32-23-13-11-22(12-14-23)26-25(29)21-9-7-20(8-10-21)19-27-15-17-28(18-16-27)33(30,31)24-5-3-2-4-6-24/h2-14H,15-19H2,1H3,(H,26,29)