N-[1-(2-methylphenoxy)propan-2-yl]-3-[[4-(phenylsulfonyl)piperazin-1-yl]methyl]benzamide

Systemtic Name: N-[1-(2-methylphenoxy)propan-2-yl]-3-[[4-(phenylsulfonyl)piperazin-1-yl]methyl]benzamide Openeye Name: 3-[[4-(benzenesulfonyl)piperazin-1-yl]methyl]-N-[1-methyl-2-(2-methylphenoxy)ethyl]benzamide CAS Name: 3-[[4-(benzenesulfonyl)-1-piperazinyl]methyl]-N-[1-(2-methylphenoxy)propan-2-yl]benzamide IUPAC Name: 3-[[4-(benzenesulfonyl)piperazin-1-yl]methyl]-N-[1-(2-methylphenoxy)propan-2-yl]benzamide Traditional Name: 3-[(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(=CC=C2)CN3CCN(CC3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

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

InChI

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