N,N-diethyl-4-[[4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]sulfonyl]benzenesulfonamide

Systemtic Name: N,N-diethyl-4-[[4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]sulfonyl]benzenesulfonamide Openeye Name: N,N-diethyl-4-[[4-(p-tolylmethyl)-1,4-diazepan-1-yl]sulfonyl]benzenesulfonamide CAS Name: N,N-diethyl-4-[[4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]sulfonyl]benzenesulfonamide IUPAC Name: N,N-diethyl-4-[[4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]sulfonyl]benzenesulfonamide Traditional Name: N,N-diethyl-4-[[4-(4-methylbenzyl)-1,4-diazepan-1-yl]sulfonyl]benzenesulfonamide Formula: C23H33N3O4S2 MolecularWeight: 479.65582

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCCN(CC2)CC3=CC=C(C=C3)C

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCCN(CC2)CC3=CC=C(C=C3)C

InChI

InChI=1S/C23H33N3O4S2/c1-4-25(5-2)31(27,28)22-11-13-23(14-12-22)32(29,30)26-16-6-15-24(17-18-26)19-21-9-7-20(3)8-10-21/h7-14H,4-6,15-19H2,1-3H3