2-ethyl-N-(3-imidazol-1-ylpropyl)-5-(phenylsulfonyl)benzenesulfonamide

Systemtic Name: 2-ethyl-N-(3-imidazol-1-ylpropyl)-5-(phenylsulfonyl)benzenesulfonamide Openeye Name: 5-(benzenesulfonyl)-2-ethyl-N-(3-imidazol-1-ylpropyl)benzenesulfonamide CAS Name: 5-(benzenesulfonyl)-2-ethyl-N-[3-(1-imidazolyl)propyl]benzenesulfonamide IUPAC Name: 5-(benzenesulfonyl)-2-ethyl-N-(3-imidazol-1-ylpropyl)benzenesulfonamide Traditional Name: 5-besyl-2-ethyl-N-(3-imidazol-1-ylpropyl)benzenesulfonamide Formula: C20H23N3O4S2 MolecularWeight: 433.54432

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C=C1)S(=O)(=O)C2=CC=CC=C2)S(=O)(=O)NCCCN3C=CN=C3

Isomeric SMILES

CCC1=C(C=C(C=C1)S(=O)(=O)C2=CC=CC=C2)S(=O)(=O)NCCCN3C=CN=C3

InChI

InChI=1S/C20H23N3O4S2/c1-2-17-9-10-19(28(24,25)18-7-4-3-5-8-18)15-20(17)29(26,27)22-11-6-13-23-14-12-21-16-23/h3-5,7-10,12,14-16,22H,2,6,11,13H2,1H3