(3S)-1-(4-fluorophenyl)sulfonyl-N-[2-oxidanylidene-2-(pyridin-2-ylamino)ethyl]piperidine-3-carboxamide

Systemtic Name: (3S)-1-(4-fluorophenyl)sulfonyl-N-[2-oxidanylidene-2-(pyridin-2-ylamino)ethyl]piperidine-3-carboxamide Openeye Name: (3S)-1-(4-fluorophenyl)sulfonyl-N-[2-oxo-2-(2-pyridylamino)ethyl]piperidine-3-carboxamide CAS Name: (3S)-1-(4-fluorophenyl)sulfonyl-N-[2-oxo-2-(2-pyridinylamino)ethyl]-3-piperidinecarboxamide IUPAC Name: (3S)-1-(4-fluorophenyl)sulfonyl-N-[2-oxo-2-(pyridin-2-ylamino)ethyl]piperidine-3-carboxamide Traditional Name: (3S)-1-(4-fluorophenyl)sulfonyl-N-[2-keto-2-(2-pyridylamino)ethyl]nipecotamide Formula: C19H21FN4O4S MolecularWeight: 420.457843

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)C2=CC=C(C=C2)F)C(=O)NCC(=O)NC3=CC=CC=N3

Isomeric SMILES

C1C[C@@H](CN(C1)S(=O)(=O)C2=CC=C(C=C2)F)C(=O)NCC(=O)NC3=CC=CC=N3

InChI

InChI=1S/C19H21FN4O4S/c20-15-6-8-16(9-7-15)29(27,28)24-11-3-4-14(13-24)19(26)22-12-18(25)23-17-5-1-2-10-21-17/h1-2,5-10,14H,3-4,11-13H2,(H,22,26)(H,21,23,25)/t14-/m0/s1