3-[[4-(phenylsulfonyl)piperazin-1-yl]methyl]-N-[3-(2-propoxyphenyl)propyl]benzamide

Systemtic Name: 3-[[4-(phenylsulfonyl)piperazin-1-yl]methyl]-N-[3-(2-propoxyphenyl)propyl]benzamide Openeye Name: 3-[[4-(benzenesulfonyl)piperazin-1-yl]methyl]-N-[3-(2-propoxyphenyl)propyl]benzamide CAS Name: 3-[[4-(benzenesulfonyl)-1-piperazinyl]methyl]-N-[3-(2-propoxyphenyl)propyl]benzamide IUPAC Name: 3-[[4-(benzenesulfonyl)piperazin-1-yl]methyl]-N-[3-(2-propoxyphenyl)propyl]benzamide Traditional Name: 3-[(4-besylpiperazino)methyl]-N-[3-(2-propoxyphenyl)propyl]benzamide Formula: C30H37N3O4S MolecularWeight: 535.69748

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC=C1CCCNC(=O)C2=CC(=CC=C2)CN3CCN(CC3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CCCOC1=CC=CC=C1CCCNC(=O)C2=CC(=CC=C2)CN3CCN(CC3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C30H37N3O4S/c1-2-22-37-29-16-7-6-11-26(29)13-9-17-31-30(34)27-12-8-10-25(23-27)24-32-18-20-33(21-19-32)38(35,36)28-14-4-3-5-15-28/h3-8,10-12,14-16,23H,2,9,13,17-22,24H2,1H3,(H,31,34)