N-tert-butyl-2-[4-(phenylsulfonyl)piperazin-1-yl]ethanamide

Systemtic Name: N-tert-butyl-2-[4-(phenylsulfonyl)piperazin-1-yl]ethanamide Openeye Name: 2-[4-(benzenesulfonyl)piperazin-1-yl]-N-tert-butyl-acetamide CAS Name: 2-[4-(benzenesulfonyl)-1-piperazinyl]-N-tert-butylacetamide IUPAC Name: 2-[4-(benzenesulfonyl)piperazin-1-yl]-N-tert-butylacetamide Traditional Name: 2-(4-besylpiperazino)-N-tert-butyl-acetamide Formula: C16H25N3O3S MolecularWeight: 339.453

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)CN1CCN(CC1)S(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

CC(C)(C)NC(=O)CN1CCN(CC1)S(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C16H25N3O3S/c1-16(2,3)17-15(20)13-18-9-11-19(12-10-18)23(21,22)14-7-5-4-6-8-14/h4-8H,9-13H2,1-3H3,(H,17,20)