N-[2-(4-dimethylaminophenyl)-2-pyrrolidin-1-yl-ethyl]-3-ethanoyl-benzenesulfonamide

Systemtic Name: N-[2-(4-dimethylaminophenyl)-2-pyrrolidin-1-yl-ethyl]-3-ethanoyl-benzenesulfonamide Openeye Name: 3-acetyl-N-[2-(4-dimethylaminophenyl)-2-pyrrolidin-1-yl-ethyl]benzenesulfonamide CAS Name: 3-acetyl-N-[2-(4-dimethylaminophenyl)-2-(1-pyrrolidinyl)ethyl]benzenesulfonamide IUPAC Name: 3-acetyl-N-[2-(4-dimethylaminophenyl)-2-pyrrolidin-1-ylethyl]benzenesulfonamide Traditional Name: 3-acetyl-N-[2-(4-dimethylaminophenyl)-2-pyrrolidino-ethyl]benzenesulfonamide Formula: C22H29N3O3S MolecularWeight: 415.54896

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H29N3O3S/c1-17(26)19-7-6-8-21(15-19)29(27,28)23-16-22(25-13-4-5-14-25)18-9-11-20(12-10-18)24(2)3/h6-12,15,22-23H,4-5,13-14,16H2,1-3H3