N-butyl-N'-[[(2S)-3-(4-fluoranyl-3-methyl-phenyl)sulfonyl-1,3-oxazinan-2-yl]methyl]ethanediamide

Systemtic Name: N-butyl-N'-[[(2S)-3-(4-fluoranyl-3-methyl-phenyl)sulfonyl-1,3-oxazinan-2-yl]methyl]ethanediamide Openeye Name: N-butyl-N'-[[(2S)-3-(4-fluoro-3-methyl-phenyl)sulfonyl-1,3-oxazinan-2-yl]methyl]oxamide CAS Name: N-butyl-N'-[[(2S)-3-(4-fluoro-3-methylphenyl)sulfonyl-1,3-oxazinan-2-yl]methyl]oxamide IUPAC Name: N-butyl-N'-[[(2S)-3-(4-fluoro-3-methylphenyl)sulfonyl-1,3-oxazinan-2-yl]methyl]oxamide Traditional Name: N-butyl-N'-[[(2S)-3-(4-fluoro-3-methyl-phenyl)sulfonyl-1,3-oxazinan-2-yl]methyl]oxamide Formula: C18H26FN3O5S MolecularWeight: 415.479543

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C(=O)NCC1N(CCCO1)S(=O)(=O)C2=CC(=C(C=C2)F)C

Isomeric SMILES

CCCCNC(=O)C(=O)NC[C@H]1N(CCCO1)S(=O)(=O)C2=CC(=C(C=C2)F)C

InChI

InChI=1S/C18H26FN3O5S/c1-3-4-8-20-17(23)18(24)21-12-16-22(9-5-10-27-16)28(25,26)14-6-7-15(19)13(2)11-14/h6-7,11,16H,3-5,8-10,12H2,1-2H3,(H,20,23)(H,21,24)/t16-/m0/s1