N-(2-methoxy-5-morpholin-4-ylsulfonyl-phenyl)-4-[[4-(phenylsulfonyl)piperazin-1-yl]methyl]benzamide

Systemtic Name: N-(2-methoxy-5-morpholin-4-ylsulfonyl-phenyl)-4-[[4-(phenylsulfonyl)piperazin-1-yl]methyl]benzamide Openeye Name: 4-[[4-(benzenesulfonyl)piperazin-1-yl]methyl]-N-(2-methoxy-5-morpholinosulfonyl-phenyl)benzamide CAS Name: 4-[[4-(benzenesulfonyl)-1-piperazinyl]methyl]-N-[2-methoxy-5-(4-morpholinylsulfonyl)phenyl]benzamide IUPAC Name: 4-[[4-(benzenesulfonyl)piperazin-1-yl]methyl]-N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)benzamide Traditional Name: 4-[(4-besylpiperazino)methyl]-N-(2-methoxy-5-morpholinosulfonyl-phenyl)benzamide Formula: C29H34N4O7S2 MolecularWeight: 614.73286

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)NC(=O)C3=CC=C(C=C3)CN4CCN(CC4)S(=O)(=O)C5=CC=CC=C5

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)NC(=O)C3=CC=C(C=C3)CN4CCN(CC4)S(=O)(=O)C5=CC=CC=C5

InChI

InChI=1S/C29H34N4O7S2/c1-39-28-12-11-26(42(37,38)33-17-19-40-20-18-33)21-27(28)30-29(34)24-9-7-23(8-10-24)22-31-13-15-32(16-14-31)41(35,36)25-5-3-2-4-6-25/h2-12,21H,13-20,22H2,1H3,(H,30,34)