N-[(2S)-1-[(3-chlorophenyl)methylamino]-1-oxidanylidene-propan-2-yl]-1-(phenylsulfonyl)piperidine-4-carboxamide

Systemtic Name: N-[(2S)-1-[(3-chlorophenyl)methylamino]-1-oxidanylidene-propan-2-yl]-1-(phenylsulfonyl)piperidine-4-carboxamide Openeye Name: 1-(benzenesulfonyl)-N-[(1S)-2-[(3-chlorophenyl)methylamino]-1-methyl-2-oxo-ethyl]piperidine-4-carboxamide CAS Name: 1-(benzenesulfonyl)-N-[(2S)-1-[(3-chlorophenyl)methylamino]-1-oxopropan-2-yl]-4-piperidinecarboxamide IUPAC Name: 1-(benzenesulfonyl)-N-[(2S)-1-[(3-chlorophenyl)methylamino]-1-oxopropan-2-yl]piperidine-4-carboxamide Traditional Name: 1-besyl-N-[(1S)-2-[(3-chlorobenzyl)amino]-2-keto-1-methyl-ethyl]isonipecotamide Formula: C22H26ClN3O4S MolecularWeight: 463.97754

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC(=CC=C1)Cl)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

C[C@@H](C(=O)NCC1=CC(=CC=C1)Cl)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H26ClN3O4S/c1-16(21(27)24-15-17-6-5-7-19(23)14-17)25-22(28)18-10-12-26(13-11-18)31(29,30)20-8-3-2-4-9-20/h2-9,14,16,18H,10-13,15H2,1H3,(H,24,27)(H,25,28)/t16-/m0/s1