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

Systemtic Name: N'-[[(2S)-3-(4-fluoranyl-3-methyl-phenyl)sulfonyl-1,3-oxazinan-2-yl]methyl]-N-prop-2-enyl-ethanediamide Openeye Name: N-allyl-N'-[[(2S)-3-(4-fluoro-3-methyl-phenyl)sulfonyl-1,3-oxazinan-2-yl]methyl]oxamide CAS Name: N'-[[(2S)-3-(4-fluoro-3-methylphenyl)sulfonyl-1,3-oxazinan-2-yl]methyl]-N-prop-2-enyloxamide IUPAC Name: N'-[[(2S)-3-(4-fluoro-3-methylphenyl)sulfonyl-1,3-oxazinan-2-yl]methyl]-N-prop-2-enyloxamide Traditional Name: N-allyl-N'-[[(2S)-3-(4-fluoro-3-methyl-phenyl)sulfonyl-1,3-oxazinan-2-yl]methyl]oxamide Formula: C17H22FN3O5S MolecularWeight: 399.437083

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)S(=O)(=O)N2CCCOC2CNC(=O)C(=O)NCC=C)F

Isomeric SMILES

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

InChI

InChI=1S/C17H22FN3O5S/c1-3-7-19-16(22)17(23)20-11-15-21(8-4-9-26-15)27(24,25)13-5-6-14(18)12(2)10-13/h3,5-6,10,15H,1,4,7-9,11H2,2H3,(H,19,22)(H,20,23)/t15-/m0/s1