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

Systemtic Name: 2-ethyl-5-(phenylsulfonyl)-N-(3-pyrrolidin-1-ylpropyl)benzenesulfonamide Openeye Name: 5-(benzenesulfonyl)-2-ethyl-N-(3-pyrrolidin-1-ylpropyl)benzenesulfonamide CAS Name: 5-(benzenesulfonyl)-2-ethyl-N-[3-(1-pyrrolidinyl)propyl]benzenesulfonamide IUPAC Name: 5-(benzenesulfonyl)-2-ethyl-N-(3-pyrrolidin-1-ylpropyl)benzenesulfonamide Traditional Name: 5-besyl-2-ethyl-N-(3-pyrrolidinopropyl)benzenesulfonamide Formula: C21H28N2O4S2 MolecularWeight: 436.58802

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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)NCCCN3CCCC3

Isomeric SMILES

CCC1=C(C=C(C=C1)S(=O)(=O)C2=CC=CC=C2)S(=O)(=O)NCCCN3CCCC3

InChI

InChI=1S/C21H28N2O4S2/c1-2-18-11-12-20(28(24,25)19-9-4-3-5-10-19)17-21(18)29(26,27)22-13-8-16-23-14-6-7-15-23/h3-5,9-12,17,22H,2,6-8,13-16H2,1H3