methyl 3-[(2R)-1-[(4-morpholin-4-ylsulfonylphenyl)amino]-1-oxidanylidene-propan-2-yl]sulfanylpropanoate

Systemtic Name: methyl 3-[(2R)-1-[(4-morpholin-4-ylsulfonylphenyl)amino]-1-oxidanylidene-propan-2-yl]sulfanylpropanoate Openeye Name: methyl 3-[(1R)-1-methyl-2-(4-morpholinosulfonylanilino)-2-oxo-ethyl]sulfanylpropanoate CAS Name: 3-[[(2R)-1-[4-(4-morpholinylsulfonyl)anilino]-1-oxopropan-2-yl]thio]propanoic acid methyl ester IUPAC Name: methyl 3-[(2R)-1-(4-morpholin-4-ylsulfonylanilino)-1-oxopropan-2-yl]sulfanylpropanoate Traditional Name: 3-[[(1R)-2-keto-1-methyl-2-(4-morpholinosulfonylanilino)ethyl]thio]propionic acid methyl ester Formula: C17H24N2O6S2 MolecularWeight: 416.51226

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCOCC2)SCCC(=O)OC

Isomeric SMILES

C[C@H](C(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCOCC2)SCCC(=O)OC

InChI

InChI=1S/C17H24N2O6S2/c1-13(26-12-7-16(20)24-2)17(21)18-14-3-5-15(6-4-14)27(22,23)19-8-10-25-11-9-19/h3-6,13H,7-12H2,1-2H3,(H,18,21)/t13-/m1/s1