2-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-N-[(2S)-2-phenylbutyl]ethanamide

Systemtic Name: 2-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-N-[(2S)-2-phenylbutyl]ethanamide Openeye Name: N-[(2S)-2-phenylbutyl]-2-[4-(p-tolylsulfonyl)piperazin-1-yl]acetamide CAS Name: 2-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]-N-[(2S)-2-phenylbutyl]acetamide IUPAC Name: 2-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-N-[(2S)-2-phenylbutyl]acetamide Traditional Name: N-[(2S)-2-phenylbutyl]-2-(4-tosylpiperazino)acetamide Formula: C23H31N3O3S MolecularWeight: 429.57554

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H31N3O3S/c1-3-20(21-7-5-4-6-8-21)17-24-23(27)18-25-13-15-26(16-14-25)30(28,29)22-11-9-19(2)10-12-22/h4-12,20H,3,13-18H2,1-2H3,(H,24,27)/t20-/m1/s1