(2-morpholin-4-yl-2-oxidanylidene-ethyl) (2R)-2-[(4-chlorophenyl)carbonylamino]-4-methylsulfanyl-butanoate

Systemtic Name: (2-morpholin-4-yl-2-oxidanylidene-ethyl) (2R)-2-[(4-chlorophenyl)carbonylamino]-4-methylsulfanyl-butanoate Openeye Name: (2-morpholino-2-oxo-ethyl) (2R)-2-[(4-chlorobenzoyl)amino]-4-methylsulfanyl-butanoate CAS Name: (2R)-2-[[(4-chlorophenyl)-oxomethyl]amino]-4-(methylthio)butanoic acid [2-(4-morpholinyl)-2-oxoethyl] ester IUPAC Name: (2-morpholin-4-yl-2-oxoethyl) (2R)-2-[(4-chlorobenzoyl)amino]-4-methylsulfanylbutanoate Traditional Name: (2R)-2-[(4-chlorobenzoyl)amino]-4-(methylthio)butyric acid (2-keto-2-morpholino-ethyl) ester Formula: C18H23ClN2O5S MolecularWeight: 414.90362

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)OCC(=O)N1CCOCC1)NC(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CSCC[C@H](C(=O)OCC(=O)N1CCOCC1)NC(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C18H23ClN2O5S/c1-27-11-6-15(20-17(23)13-2-4-14(19)5-3-13)18(24)26-12-16(22)21-7-9-25-10-8-21/h2-5,15H,6-12H2,1H3,(H,20,23)/t15-/m1/s1