[2-oxidanylidene-2-(propan-2-ylcarbamoylamino)ethyl] (2S)-2-[(4-fluorophenyl)sulfonylamino]propanoate

Systemtic Name: [2-oxidanylidene-2-(propan-2-ylcarbamoylamino)ethyl] (2S)-2-[(4-fluorophenyl)sulfonylamino]propanoate Openeye Name: [2-(isopropylcarbamoylamino)-2-oxo-ethyl] (2S)-2-[(4-fluorophenyl)sulfonylamino]propanoate CAS Name: (2S)-2-[(4-fluorophenyl)sulfonylamino]propanoic acid [2-oxo-2-[[oxo-(propan-2-ylamino)methyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-(propan-2-ylcarbamoylamino)ethyl] (2S)-2-[(4-fluorophenyl)sulfonylamino]propanoate Traditional Name: (2S)-2-[(4-fluorophenyl)sulfonylamino]propionic acid [2-(isopropylcarbamoylamino)-2-keto-ethyl] ester Formula: C15H20FN3O6S MolecularWeight: 389.399203

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)NC(=O)COC(=O)C(C)NS(=O)(=O)C1=CC=C(C=C1)F

Isomeric SMILES

C[C@@H](C(=O)OCC(=O)NC(=O)NC(C)C)NS(=O)(=O)C1=CC=C(C=C1)F

InChI

InChI=1S/C15H20FN3O6S/c1-9(2)17-15(22)18-13(20)8-25-14(21)10(3)19-26(23,24)12-6-4-11(16)5-7-12/h4-7,9-10,19H,8H2,1-3H3,(H2,17,18,20,22)/t10-/m0/s1