N-[(2S)-2-phenylbutyl]-2-[4-(phenylsulfonyl)piperazin-1-yl]ethanamide

Systemtic Name: N-[(2S)-2-phenylbutyl]-2-[4-(phenylsulfonyl)piperazin-1-yl]ethanamide Openeye Name: 2-[4-(benzenesulfonyl)piperazin-1-yl]-N-[(2S)-2-phenylbutyl]acetamide CAS Name: 2-[4-(benzenesulfonyl)-1-piperazinyl]-N-[(2S)-2-phenylbutyl]acetamide IUPAC Name: 2-[4-(benzenesulfonyl)piperazin-1-yl]-N-[(2S)-2-phenylbutyl]acetamide Traditional Name: 2-(4-besylpiperazino)-N-[(2S)-2-phenylbutyl]acetamide Formula: C22H29N3O3S MolecularWeight: 415.54896

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CNC(=O)CN1CCN(CC1)S(=O)(=O)C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CC[C@H](CNC(=O)CN1CCN(CC1)S(=O)(=O)C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C22H29N3O3S/c1-2-19(20-9-5-3-6-10-20)17-23-22(26)18-24-13-15-25(16-14-24)29(27,28)21-11-7-4-8-12-21/h3-12,19H,2,13-18H2,1H3,(H,23,26)/t19-/m1/s1