N-[(2R)-2-(4-methylphenyl)-2-morpholin-4-yl-ethyl]-N'-(3-methylsulfanylphenyl)ethanediamide

Systemtic Name: N-[(2R)-2-(4-methylphenyl)-2-morpholin-4-yl-ethyl]-N'-(3-methylsulfanylphenyl)ethanediamide Openeye Name: N'-(3-methylsulfanylphenyl)-N-[(2R)-2-morpholino-2-(p-tolyl)ethyl]oxamide CAS Name: N-[(2R)-2-(4-methylphenyl)-2-(4-morpholinyl)ethyl]-N'-[3-(methylthio)phenyl]oxamide IUPAC Name: N-[(2R)-2-(4-methylphenyl)-2-morpholin-4-ylethyl]-N'-(3-methylsulfanylphenyl)oxamide Traditional Name: N'-[3-(methylthio)phenyl]-N-[(2R)-2-morpholino-2-(p-tolyl)ethyl]oxamide Formula: C22H27N3O3S MolecularWeight: 413.53308

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(CNC(=O)C(=O)NC2=CC(=CC=C2)SC)N3CCOCC3

Isomeric SMILES

CC1=CC=C(C=C1)[C@H](CNC(=O)C(=O)NC2=CC(=CC=C2)SC)N3CCOCC3

InChI

InChI=1S/C22H27N3O3S/c1-16-6-8-17(9-7-16)20(25-10-12-28-13-11-25)15-23-21(26)22(27)24-18-4-3-5-19(14-18)29-2/h3-9,14,20H,10-13,15H2,1-2H3,(H,23,26)(H,24,27)/t20-/m0/s1