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

Systemtic Name: N-[(4-methoxyphenyl)methyl]-3-[[4-(phenylsulfonyl)piperazin-1-yl]methyl]benzamide Openeye Name: 3-[[4-(benzenesulfonyl)piperazin-1-yl]methyl]-N-[(4-methoxyphenyl)methyl]benzamide CAS Name: 3-[[4-(benzenesulfonyl)-1-piperazinyl]methyl]-N-[(4-methoxyphenyl)methyl]benzamide IUPAC Name: 3-[[4-(benzenesulfonyl)piperazin-1-yl]methyl]-N-[(4-methoxyphenyl)methyl]benzamide Traditional Name: 3-[(4-besylpiperazino)methyl]-N-p-anisyl-benzamide Formula: C26H29N3O4S MolecularWeight: 479.59116

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H29N3O4S/c1-33-24-12-10-21(11-13-24)19-27-26(30)23-7-5-6-22(18-23)20-28-14-16-29(17-15-28)34(31,32)25-8-3-2-4-9-25/h2-13,18H,14-17,19-20H2,1H3,(H,27,30)