N-[2-(4-dimethylaminophenyl)-2-pyrrolidin-1-yl-ethyl]-2,5-dimethyl-benzenesulfonamide

Systemtic Name: N-[2-(4-dimethylaminophenyl)-2-pyrrolidin-1-yl-ethyl]-2,5-dimethyl-benzenesulfonamide Openeye Name: N-[2-(4-dimethylaminophenyl)-2-pyrrolidin-1-yl-ethyl]-2,5-dimethyl-benzenesulfonamide CAS Name: N-[2-(4-dimethylaminophenyl)-2-(1-pyrrolidinyl)ethyl]-2,5-dimethylbenzenesulfonamide IUPAC Name: N-[2-(4-dimethylaminophenyl)-2-pyrrolidin-1-ylethyl]-2,5-dimethylbenzenesulfonamide Traditional Name: N-[2-(4-dimethylaminophenyl)-2-pyrrolidino-ethyl]-2,5-dimethyl-benzenesulfonamide Formula: C22H31N3O2S MolecularWeight: 401.56544

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)NCC(C2=CC=C(C=C2)N(C)C)N3CCCC3

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)NCC(C2=CC=C(C=C2)N(C)C)N3CCCC3

InChI

InChI=1S/C22H31N3O2S/c1-17-7-8-18(2)22(15-17)28(26,27)23-16-21(25-13-5-6-14-25)19-9-11-20(12-10-19)24(3)4/h7-12,15,21,23H,5-6,13-14,16H2,1-4H3