N-butyl-4-[[4-(4,5-dihydro-1H-imidazol-2-ylamino)phenyl]methyl]benzenesulfonamide; ethanedioic acid

Systemtic Name: N-butyl-4-[[4-(4,5-dihydro-1H-imidazol-2-ylamino)phenyl]methyl]benzenesulfonamide; ethanedioic acid Openeye Name: N-butyl-4-[[4-(4,5-dihydro-1H-imidazol-2-ylamino)phenyl]methyl]benzenesulfonamide; oxalic acid CAS Name: N-butyl-4-[[4-(4,5-dihydro-1H-imidazol-2-ylamino)phenyl]methyl]benzenesulfonamide; oxalic acid IUPAC Name: N-butyl-4-[[4-(4,5-dihydro-1H-imidazol-2-ylamino)phenyl]methyl]benzenesulfonamide; oxalic acid Traditional Name: N-butyl-4-[4-(2-imidazolin-2-ylamino)benzyl]benzenesulfonamide; oxalic acid Formula: C22H28N4O6S MolecularWeight: 476.54592

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNS(=O)(=O)C1=CC=C(C=C1)CC2=CC=C(C=C2)NC3=NCCN3.C(=O)(C(=O)O)O

Isomeric SMILES

CCCCNS(=O)(=O)C1=CC=C(C=C1)CC2=CC=C(C=C2)NC3=NCCN3.C(=O)(C(=O)O)O

InChI

InChI=1S/C20H26N4O2S.C2H2O4/c1-2-3-12-23-27(25,26)19-10-6-17(7-11-19)15-16-4-8-18(9-5-16)24-20-21-13-14-22-20;3-1(4)2(5)6/h4-11,23H,2-3,12-15H2,1H3,(H2,21,22,24);(H,3,4)(H,5,6)