4-[[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methyl]-N-[1-(4-pyrrolidin-1-ylphenyl)ethyl]benzamide

Systemtic Name: 4-[[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methyl]-N-[1-(4-pyrrolidin-1-ylphenyl)ethyl]benzamide Openeye Name: 4-[[4-(p-tolylsulfonyl)piperazin-1-yl]methyl]-N-[1-(4-pyrrolidin-1-ylphenyl)ethyl]benzamide CAS Name: 4-[[4-(4-methylphenyl)sulfonyl-1-piperazinyl]methyl]-N-[1-[4-(1-pyrrolidinyl)phenyl]ethyl]benzamide IUPAC Name: 4-[[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methyl]-N-[1-(4-pyrrolidin-1-ylphenyl)ethyl]benzamide Traditional Name: N-[1-(4-pyrrolidinophenyl)ethyl]-4-[(4-tosylpiperazino)methyl]benzamide Formula: C31H38N4O3S MolecularWeight: 546.72342

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=CC=C(C=C3)C(=O)NC(C)C4=CC=C(C=C4)N5CCCC5

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=CC=C(C=C3)C(=O)NC(C)C4=CC=C(C=C4)N5CCCC5

InChI

InChI=1S/C31H38N4O3S/c1-24-5-15-30(16-6-24)39(37,38)35-21-19-33(20-22-35)23-26-7-9-28(10-8-26)31(36)32-25(2)27-11-13-29(14-12-27)34-17-3-4-18-34/h5-16,25H,3-4,17-23H2,1-2H3,(H,32,36)