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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)S(=O)(=O)NCC(C2=CC=C(C=C2)N(C)C)N3CCCC3

Isomeric SMILES

CCC1=CC=C(C=C1)S(=O)(=O)NCC(C2=CC=C(C=C2)N(C)C)N3CCCC3

InChI

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