(2S)-N-[(2R)-4-phenylbutan-2-yl]-2-[4-(phenylsulfonyl)piperazin-1-yl]propanamide

Systemtic Name: (2S)-N-[(2R)-4-phenylbutan-2-yl]-2-[4-(phenylsulfonyl)piperazin-1-yl]propanamide Openeye Name: (2S)-2-[4-(benzenesulfonyl)piperazin-1-yl]-N-[(1R)-1-methyl-3-phenyl-propyl]propanamide CAS Name: (2S)-2-[4-(benzenesulfonyl)-1-piperazinyl]-N-[(2R)-4-phenylbutan-2-yl]propanamide IUPAC Name: (2S)-2-[4-(benzenesulfonyl)piperazin-1-yl]-N-[(2R)-4-phenylbutan-2-yl]propanamide Traditional Name: (2S)-2-(4-besylpiperazino)-N-[(1R)-1-methyl-3-phenyl-propyl]propionamide Formula: C23H31N3O3S MolecularWeight: 429.57554

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=CC=C1)NC(=O)C(C)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

C[C@H](CCC1=CC=CC=C1)NC(=O)[C@H](C)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C23H31N3O3S/c1-19(13-14-21-9-5-3-6-10-21)24-23(27)20(2)25-15-17-26(18-16-25)30(28,29)22-11-7-4-8-12-22/h3-12,19-20H,13-18H2,1-2H3,(H,24,27)/t19-,20+/m1/s1