N-[(2S)-4-methyl-1-oxidanylidene-1-(pyridin-4-ylmethylamino)pentan-2-yl]-1-(phenylsulfonyl)piperidine-4-carboxamide

Systemtic Name: N-[(2S)-4-methyl-1-oxidanylidene-1-(pyridin-4-ylmethylamino)pentan-2-yl]-1-(phenylsulfonyl)piperidine-4-carboxamide Openeye Name: 1-(benzenesulfonyl)-N-[(1S)-3-methyl-1-(4-pyridylmethylcarbamoyl)butyl]piperidine-4-carboxamide CAS Name: 1-(benzenesulfonyl)-N-[(2S)-4-methyl-1-oxo-1-(pyridin-4-ylmethylamino)pentan-2-yl]-4-piperidinecarboxamide IUPAC Name: 1-(benzenesulfonyl)-N-[(2S)-4-methyl-1-oxo-1-(pyridin-4-ylmethylamino)pentan-2-yl]piperidine-4-carboxamide Traditional Name: 1-besyl-N-[(1S)-3-methyl-1-(4-pyridylmethylcarbamoyl)butyl]isonipecotamide Formula: C24H32N4O4S MolecularWeight: 472.60028

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H32N4O4S/c1-18(2)16-22(24(30)26-17-19-8-12-25-13-9-19)27-23(29)20-10-14-28(15-11-20)33(31,32)21-6-4-3-5-7-21/h3-9,12-13,18,20,22H,10-11,14-17H2,1-2H3,(H,26,30)(H,27,29)/t22-/m0/s1