N-[(5S)-5-azanyl-6-(3-fluoranylazetidin-1-yl)-6-oxidanylidene-hexyl]-3-methyl-quinoxaline-2-carboxamide

Systemtic Name: N-[(5S)-5-azanyl-6-(3-fluoranylazetidin-1-yl)-6-oxidanylidene-hexyl]-3-methyl-quinoxaline-2-carboxamide Openeye Name: N-[(5S)-5-amino-6-(3-fluoroazetidin-1-yl)-6-oxo-hexyl]-3-methyl-quinoxaline-2-carboxamide CAS Name: N-[(5S)-5-amino-6-(3-fluoro-1-azetidinyl)-6-oxohexyl]-3-methyl-2-quinoxalinecarboxamide IUPAC Name: N-[(5S)-5-amino-6-(3-fluoroazetidin-1-yl)-6-oxohexyl]-3-methylquinoxaline-2-carboxamide Traditional Name: N-[(5S)-5-amino-6-(3-fluoroazetidin-1-yl)-6-keto-hexyl]-3-methyl-quinoxaline-2-carboxamide Formula: C19H24FN5O2 MolecularWeight: 373.424563

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2N=C1C(=O)NCCCCC(C(=O)N3CC(C3)F)N

Isomeric SMILES

CC1=NC2=CC=CC=C2N=C1C(=O)NCCCC[C@@H](C(=O)N3CC(C3)F)N

InChI

InChI=1S/C19H24FN5O2/c1-12-17(24-16-8-3-2-7-15(16)23-12)18(26)22-9-5-4-6-14(21)19(27)25-10-13(20)11-25/h2-3,7-8,13-14H,4-6,9-11,21H2,1H3,(H,22,26)/t14-/m0/s1