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

Systemtic Name: (3S)-1-(4-fluorophenyl)sulfonyl-N-[2-oxidanylidene-2-(pyridin-3-ylamino)ethyl]piperidine-3-carboxamide Openeye Name: (3S)-1-(4-fluorophenyl)sulfonyl-N-[2-oxo-2-(3-pyridylamino)ethyl]piperidine-3-carboxamide CAS Name: (3S)-1-(4-fluorophenyl)sulfonyl-N-[2-oxo-2-(3-pyridinylamino)ethyl]-3-piperidinecarboxamide IUPAC Name: (3S)-1-(4-fluorophenyl)sulfonyl-N-[2-oxo-2-(pyridin-3-ylamino)ethyl]piperidine-3-carboxamide Traditional Name: (3S)-1-(4-fluorophenyl)sulfonyl-N-[2-keto-2-(3-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=CN=CC=C3

Isomeric SMILES

C1C[C@@H](CN(C1)S(=O)(=O)C2=CC=C(C=C2)F)C(=O)NCC(=O)NC3=CN=CC=C3

InChI

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