[2-azanyl-2-(phenylsulfonylamino)propanoyl] 2-[2-(4,5-dihydro-1H-imidazol-2-ylamino)propoxy]benzoate

Systemtic Name: [2-azanyl-2-(phenylsulfonylamino)propanoyl] 2-[2-(4,5-dihydro-1H-imidazol-2-ylamino)propoxy]benzoate Openeye Name: [2-amino-2-(benzenesulfonamido)propanoyl] 2-[2-(4,5-dihydro-1H-imidazol-2-ylamino)propoxy]benzoate CAS Name: 2-[2-(4,5-dihydro-1H-imidazol-2-ylamino)propoxy]benzoic acid [2-amino-2-(benzenesulfonamido)-1-oxopropyl] ester IUPAC Name: [2-amino-2-(benzenesulfonamido)propanoyl] 2-[2-(4,5-dihydro-1H-imidazol-2-ylamino)propoxy]benzoate Traditional Name: 2-[2-(2-imidazolin-2-ylamino)propoxy]benzoic acid [2-amino-2-(benzenesulfonamido)propanoyl] ester Formula: C22H27N5O6S MolecularWeight: 489.54468

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC1=CC=CC=C1C(=O)OC(=O)C(C)(N)NS(=O)(=O)C2=CC=CC=C2)NC3=NCCN3

Isomeric SMILES

CC(COC1=CC=CC=C1C(=O)OC(=O)C(C)(N)NS(=O)(=O)C2=CC=CC=C2)NC3=NCCN3

InChI

InChI=1S/C22H27N5O6S/c1-15(26-21-24-12-13-25-21)14-32-18-11-7-6-10-17(18)19(28)33-20(29)22(2,23)27-34(30,31)16-8-4-3-5-9-16/h3-11,15,27H,12-14,23H2,1-2H3,(H2,24,25,26)