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

Systemtic Name: 2-methoxy-5-(phenylsulfonyl)-N-(3-pyrrolidin-1-ylpropyl)benzenesulfonamide Openeye Name: 5-(benzenesulfonyl)-2-methoxy-N-(3-pyrrolidin-1-ylpropyl)benzenesulfonamide CAS Name: 5-(benzenesulfonyl)-2-methoxy-N-[3-(1-pyrrolidinyl)propyl]benzenesulfonamide IUPAC Name: 5-(benzenesulfonyl)-2-methoxy-N-(3-pyrrolidin-1-ylpropyl)benzenesulfonamide Traditional Name: 5-besyl-2-methoxy-N-(3-pyrrolidinopropyl)benzenesulfonamide Formula: C20H26N2O5S2 MolecularWeight: 438.56084

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)C2=CC=CC=C2)S(=O)(=O)NCCCN3CCCC3

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)C2=CC=CC=C2)S(=O)(=O)NCCCN3CCCC3

InChI

InChI=1S/C20H26N2O5S2/c1-27-19-11-10-18(28(23,24)17-8-3-2-4-9-17)16-20(19)29(25,26)21-12-7-15-22-13-5-6-14-22/h2-4,8-11,16,21H,5-7,12-15H2,1H3