methyl 2-[(2R)-1-oxidanylidene-1-[[4-(pyrimidin-2-ylsulfamoyl)phenyl]amino]propan-2-yl]sulfanylethanoate

Systemtic Name: methyl 2-[(2R)-1-oxidanylidene-1-[[4-(pyrimidin-2-ylsulfamoyl)phenyl]amino]propan-2-yl]sulfanylethanoate Openeye Name: methyl 2-[(1R)-1-methyl-2-oxo-2-[4-(pyrimidin-2-ylsulfamoyl)anilino]ethyl]sulfanylacetate CAS Name: 2-[[(2R)-1-oxo-1-[4-(2-pyrimidinylsulfamoyl)anilino]propan-2-yl]thio]acetic acid methyl ester IUPAC Name: methyl 2-[(2R)-1-oxo-1-[4-(pyrimidin-2-ylsulfamoyl)anilino]propan-2-yl]sulfanylacetate Traditional Name: 2-[[(1R)-2-keto-1-methyl-2-[4-(2-pyrimidylsulfamoyl)anilino]ethyl]thio]acetic acid methyl ester Formula: C16H18N4O5S2 MolecularWeight: 410.46792

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)NC2=NC=CC=N2)SCC(=O)OC

Isomeric SMILES

C[C@H](C(=O)NC1=CC=C(C=C1)S(=O)(=O)NC2=NC=CC=N2)SCC(=O)OC

InChI

InChI=1S/C16H18N4O5S2/c1-11(26-10-14(21)25-2)15(22)19-12-4-6-13(7-5-12)27(23,24)20-16-17-8-3-9-18-16/h3-9,11H,10H2,1-2H3,(H,19,22)(H,17,18,20)/t11-/m1/s1