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

Systemtic Name: N,N-diethyl-3-[4-(phenylmethyl)piperazin-1-yl]carbonyl-4-pyrrolidin-1-yl-benzenesulfonamide Openeye Name: 3-(4-benzylpiperazine-1-carbonyl)-N,N-diethyl-4-pyrrolidin-1-yl-benzenesulfonamide CAS Name: N,N-diethyl-3-[oxo-[4-(phenylmethyl)-1-piperazinyl]methyl]-4-(1-pyrrolidinyl)benzenesulfonamide IUPAC Name: 3-(4-benzylpiperazine-1-carbonyl)-N,N-diethyl-4-pyrrolidin-1-ylbenzenesulfonamide Traditional Name: 3-(4-benzylpiperazine-1-carbonyl)-N,N-diethyl-4-pyrrolidino-benzenesulfonamide Formula: C26H36N4O3S MolecularWeight: 484.65404

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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)CC4=CC=CC=C4

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)N2CCCC2)C(=O)N3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C26H36N4O3S/c1-3-30(4-2)34(32,33)23-12-13-25(28-14-8-9-15-28)24(20-23)26(31)29-18-16-27(17-19-29)21-22-10-6-5-7-11-22/h5-7,10-13,20H,3-4,8-9,14-19,21H2,1-2H3