2-[4-(phenylsulfonyl)piperazin-1-yl]-N-(4-pyrrolidin-1-ylphenyl)ethanamide

Systemtic Name: 2-[4-(phenylsulfonyl)piperazin-1-yl]-N-(4-pyrrolidin-1-ylphenyl)ethanamide Openeye Name: 2-[4-(benzenesulfonyl)piperazin-1-yl]-N-(4-pyrrolidin-1-ylphenyl)acetamide CAS Name: 2-[4-(benzenesulfonyl)-1-piperazinyl]-N-[4-(1-pyrrolidinyl)phenyl]acetamide IUPAC Name: 2-[4-(benzenesulfonyl)piperazin-1-yl]-N-(4-pyrrolidin-1-ylphenyl)acetamide Traditional Name: 2-(4-besylpiperazino)-N-(4-pyrrolidinophenyl)acetamide Formula: C22H28N4O3S MolecularWeight: 428.54772

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=CC=C(C=C2)NC(=O)CN3CCN(CC3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CCN(C1)C2=CC=C(C=C2)NC(=O)CN3CCN(CC3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C22H28N4O3S/c27-22(23-19-8-10-20(11-9-19)25-12-4-5-13-25)18-24-14-16-26(17-15-24)30(28,29)21-6-2-1-3-7-21/h1-3,6-11H,4-5,12-18H2,(H,23,27)