(3S)-N-[2-oxidanylidene-2-(quinolin-5-ylamino)ethyl]-1-(phenylsulfonyl)piperidine-3-carboxamide

Systemtic Name: (3S)-N-[2-oxidanylidene-2-(quinolin-5-ylamino)ethyl]-1-(phenylsulfonyl)piperidine-3-carboxamide Openeye Name: (3S)-1-(benzenesulfonyl)-N-[2-oxo-2-(5-quinolylamino)ethyl]piperidine-3-carboxamide CAS Name: (3S)-1-(benzenesulfonyl)-N-[2-oxo-2-(5-quinolinylamino)ethyl]-3-piperidinecarboxamide IUPAC Name: (3S)-1-(benzenesulfonyl)-N-[2-oxo-2-(quinolin-5-ylamino)ethyl]piperidine-3-carboxamide Traditional Name: (3S)-1-besyl-N-[2-keto-2-(5-quinolylamino)ethyl]nipecotamide Formula: C23H24N4O4S MolecularWeight: 452.52606

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)C2=CC=CC=C2)C(=O)NCC(=O)NC3=CC=CC4=C3C=CC=N4

Isomeric SMILES

C1C[C@@H](CN(C1)S(=O)(=O)C2=CC=CC=C2)C(=O)NCC(=O)NC3=CC=CC4=C3C=CC=N4

InChI

InChI=1S/C23H24N4O4S/c28-22(26-21-12-4-11-20-19(21)10-5-13-24-20)15-25-23(29)17-7-6-14-27(16-17)32(30,31)18-8-2-1-3-9-18/h1-5,8-13,17H,6-7,14-16H2,(H,25,29)(H,26,28)/t17-/m0/s1