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

Systemtic Name: N'-[[(2S)-3-(4-fluoranyl-2-methyl-phenyl)sulfonyl-1,3-oxazinan-2-yl]methyl]-N-phenethyl-ethanediamide Openeye Name: N'-[[(2S)-3-(4-fluoro-2-methyl-phenyl)sulfonyl-1,3-oxazinan-2-yl]methyl]-N-phenethyl-oxamide CAS Name: N'-[[(2S)-3-(4-fluoro-2-methylphenyl)sulfonyl-1,3-oxazinan-2-yl]methyl]-N-phenethyloxamide IUPAC Name: N'-[[(2S)-3-(4-fluoro-2-methylphenyl)sulfonyl-1,3-oxazinan-2-yl]methyl]-N-phenethyloxamide Traditional Name: N'-[[(2S)-3-(4-fluoro-2-methyl-phenyl)sulfonyl-1,3-oxazinan-2-yl]methyl]-N-phenethyl-oxamide Formula: C22H26FN3O5S MolecularWeight: 463.522343

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)F)S(=O)(=O)N2CCCOC2CNC(=O)C(=O)NCCC3=CC=CC=C3

Isomeric SMILES

CC1=C(C=CC(=C1)F)S(=O)(=O)N2CCCO[C@H]2CNC(=O)C(=O)NCCC3=CC=CC=C3

InChI

InChI=1S/C22H26FN3O5S/c1-16-14-18(23)8-9-19(16)32(29,30)26-12-5-13-31-20(26)15-25-22(28)21(27)24-11-10-17-6-3-2-4-7-17/h2-4,6-9,14,20H,5,10-13,15H2,1H3,(H,24,27)(H,25,28)/t20-/m0/s1