3-[4-(2,3-dimethylphenyl)piperazin-1-yl]carbonyl-N,N-diethyl-4-pyrrolidin-1-yl-benzenesulfonamide

Systemtic Name: 3-[4-(2,3-dimethylphenyl)piperazin-1-yl]carbonyl-N,N-diethyl-4-pyrrolidin-1-yl-benzenesulfonamide Openeye Name: 3-[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]-N,N-diethyl-4-pyrrolidin-1-yl-benzenesulfonamide CAS Name: 3-[[4-(2,3-dimethylphenyl)-1-piperazinyl]-oxomethyl]-N,N-diethyl-4-(1-pyrrolidinyl)benzenesulfonamide IUPAC Name: 3-[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]-N,N-diethyl-4-pyrrolidin-1-ylbenzenesulfonamide Traditional Name: 3-[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]-N,N-diethyl-4-pyrrolidino-benzenesulfonamide Formula: C27H38N4O3S MolecularWeight: 498.68062

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)N2CCCC2)C(=O)N3CCN(CC3)C4=CC=CC(=C4C)C

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)N2CCCC2)C(=O)N3CCN(CC3)C4=CC=CC(=C4C)C

InChI

InChI=1S/C27H38N4O3S/c1-5-31(6-2)35(33,34)23-12-13-26(28-14-7-8-15-28)24(20-23)27(32)30-18-16-29(17-19-30)25-11-9-10-21(3)22(25)4/h9-13,20H,5-8,14-19H2,1-4H3