diethyl 5-[(2R)-1-[(2-methylsulfanylphenyl)amino]-1-oxidanylidene-propan-2-yl]oxybenzene-1,3-dicarboxylate

Systemtic Name: diethyl 5-[(2R)-1-[(2-methylsulfanylphenyl)amino]-1-oxidanylidene-propan-2-yl]oxybenzene-1,3-dicarboxylate Openeye Name: diethyl 5-[(1R)-1-methyl-2-(2-methylsulfanylanilino)-2-oxo-ethoxy]benzene-1,3-dicarboxylate CAS Name: 5-[(2R)-1-[2-(methylthio)anilino]-1-oxopropan-2-yl]oxybenzene-1,3-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-[(2R)-1-(2-methylsulfanylanilino)-1-oxopropan-2-yl]oxybenzene-1,3-dicarboxylate Traditional Name: 5-[(1R)-2-keto-1-methyl-2-[2-(methylthio)anilino]ethoxy]benzene-1,3-dicarboxylic acid diethyl ester Formula: C22H25NO6S MolecularWeight: 431.502

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=C1)OC(C)C(=O)NC2=CC=CC=C2SC)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1)O[C@H](C)C(=O)NC2=CC=CC=C2SC)C(=O)OCC

InChI

InChI=1S/C22H25NO6S/c1-5-27-21(25)15-11-16(22(26)28-6-2)13-17(12-15)29-14(3)20(24)23-18-9-7-8-10-19(18)30-4/h7-14H,5-6H2,1-4H3,(H,23,24)/t14-/m1/s1