N-[(2S)-5-methylhexan-2-yl]-2-[4-(phenylsulfonyl)piperazin-1-yl]ethanamide

Systemtic Name: N-[(2S)-5-methylhexan-2-yl]-2-[4-(phenylsulfonyl)piperazin-1-yl]ethanamide Openeye Name: 2-[4-(benzenesulfonyl)piperazin-1-yl]-N-[(1S)-1,4-dimethylpentyl]acetamide CAS Name: 2-[4-(benzenesulfonyl)-1-piperazinyl]-N-[(2S)-5-methylhexan-2-yl]acetamide IUPAC Name: 2-[4-(benzenesulfonyl)piperazin-1-yl]-N-[(2S)-5-methylhexan-2-yl]acetamide Traditional Name: 2-(4-besylpiperazino)-N-[(1S)-1,4-dimethylpentyl]acetamide Formula: C19H31N3O3S MolecularWeight: 381.53274

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C[C@@H](CCC(C)C)NC(=O)CN1CCN(CC1)S(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C19H31N3O3S/c1-16(2)9-10-17(3)20-19(23)15-21-11-13-22(14-12-21)26(24,25)18-7-5-4-6-8-18/h4-8,16-17H,9-15H2,1-3H3,(H,20,23)/t17-/m0/s1