5-[2-[bis(phenylmethyl)amino]-1-oxidanyl-ethyl]-2-pyrrolidin-1-yl-benzenesulfonamide

Systemtic Name: 5-[2-[bis(phenylmethyl)amino]-1-oxidanyl-ethyl]-2-pyrrolidin-1-yl-benzenesulfonamide Openeye Name: 5-[2-(dibenzylamino)-1-hydroxy-ethyl]-2-pyrrolidin-1-yl-benzenesulfonamide CAS Name: 5-[2-[bis(phenylmethyl)amino]-1-hydroxyethyl]-2-(1-pyrrolidinyl)benzenesulfonamide IUPAC Name: 5-[2-(dibenzylamino)-1-hydroxyethyl]-2-pyrrolidin-1-ylbenzenesulfonamide Traditional Name: 5-[2-(dibenzylamino)-1-hydroxy-ethyl]-2-pyrrolidino-benzenesulfonamide Formula: C26H31N3O3S MolecularWeight: 465.60764

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=C(C=C2)C(CN(CC3=CC=CC=C3)CC4=CC=CC=C4)O)S(=O)(=O)N

Isomeric SMILES

C1CCN(C1)C2=C(C=C(C=C2)C(CN(CC3=CC=CC=C3)CC4=CC=CC=C4)O)S(=O)(=O)N

InChI

InChI=1S/C26H31N3O3S/c27-33(31,32)26-17-23(13-14-24(26)29-15-7-8-16-29)25(30)20-28(18-21-9-3-1-4-10-21)19-22-11-5-2-6-12-22/h1-6,9-14,17,25,30H,7-8,15-16,18-20H2,(H2,27,31,32)