[(2S)-1-(tert-butylcarbamoylamino)-1-oxidanylidene-propan-2-yl] 2-[(5-bromanylfuran-2-yl)carbonylamino]ethanoate

Systemtic Name: [(2S)-1-(tert-butylcarbamoylamino)-1-oxidanylidene-propan-2-yl] 2-[(5-bromanylfuran-2-yl)carbonylamino]ethanoate Openeye Name: [(1S)-2-(tert-butylcarbamoylamino)-1-methyl-2-oxo-ethyl] 2-[(5-bromofuran-2-carbonyl)amino]acetate CAS Name: 2-[[(5-bromo-2-furanyl)-oxomethyl]amino]acetic acid [(2S)-1-[[(tert-butylamino)-oxomethyl]amino]-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(tert-butylcarbamoylamino)-1-oxopropan-2-yl] 2-[(5-bromofuran-2-carbonyl)amino]acetate Traditional Name: 2-[(5-bromo-2-furoyl)amino]acetic acid [(1S)-2-(tert-butylcarbamoylamino)-2-keto-1-methyl-ethyl] ester Formula: C15H20BrN3O6 MolecularWeight: 418.2398

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)NC(C)(C)C)OC(=O)CNC(=O)C1=CC=C(O1)Br

Isomeric SMILES

C[C@@H](C(=O)NC(=O)NC(C)(C)C)OC(=O)CNC(=O)C1=CC=C(O1)Br

InChI

InChI=1S/C15H20BrN3O6/c1-8(12(21)18-14(23)19-15(2,3)4)24-11(20)7-17-13(22)9-5-6-10(16)25-9/h5-6,8H,7H2,1-4H3,(H,17,22)(H2,18,19,21,23)/t8-/m0/s1