N-[1-(2-methylphenoxy)propan-2-yl]-4-[[4-(phenylsulfonyl)piperazin-1-yl]methyl]benzamide

Systemtic Name: N-[1-(2-methylphenoxy)propan-2-yl]-4-[[4-(phenylsulfonyl)piperazin-1-yl]methyl]benzamide Openeye Name: 4-[[4-(benzenesulfonyl)piperazin-1-yl]methyl]-N-[1-methyl-2-(2-methylphenoxy)ethyl]benzamide CAS Name: 4-[[4-(benzenesulfonyl)-1-piperazinyl]methyl]-N-[1-(2-methylphenoxy)propan-2-yl]benzamide IUPAC Name: 4-[[4-(benzenesulfonyl)piperazin-1-yl]methyl]-N-[1-(2-methylphenoxy)propan-2-yl]benzamide Traditional Name: 4-[(4-besylpiperazino)methyl]-N-[1-methyl-2-(2-methylphenoxy)ethyl]benzamide Formula: C28H33N3O4S MolecularWeight: 507.64432

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OCC(C)NC(=O)C2=CC=C(C=C2)CN3CCN(CC3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=CC=C1OCC(C)NC(=O)C2=CC=C(C=C2)CN3CCN(CC3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C28H33N3O4S/c1-22-8-6-7-11-27(22)35-21-23(2)29-28(32)25-14-12-24(13-15-25)20-30-16-18-31(19-17-30)36(33,34)26-9-4-3-5-10-26/h3-15,23H,16-21H2,1-2H3,(H,29,32)