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

Systemtic Name: N'-[[(2S)-3-(4-methylphenyl)sulfonyl-1,3-oxazinan-2-yl]methyl]-N-phenethyl-ethanediamide Openeye Name: N-phenethyl-N'-[[(2S)-3-(p-tolylsulfonyl)-1,3-oxazinan-2-yl]methyl]oxamide CAS Name: N'-[[(2S)-3-(4-methylphenyl)sulfonyl-1,3-oxazinan-2-yl]methyl]-N-phenethyloxamide IUPAC Name: N'-[[(2S)-3-(4-methylphenyl)sulfonyl-1,3-oxazinan-2-yl]methyl]-N-phenethyloxamide Traditional Name: N-phenethyl-N'-[[(2S)-3-tosyl-1,3-oxazinan-2-yl]methyl]oxamide Formula: C22H27N3O5S MolecularWeight: 445.53188

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27N3O5S/c1-17-8-10-19(11-9-17)31(28,29)25-14-5-15-30-20(25)16-24-22(27)21(26)23-13-12-18-6-3-2-4-7-18/h2-4,6-11,20H,5,12-16H2,1H3,(H,23,26)(H,24,27)/t20-/m0/s1