[2-[[(2S)-butan-2-yl]carbamoylamino]-2-oxidanylidene-ethyl] 2-[(5-bromanylfuran-2-yl)carbonylamino]ethanoate

Systemtic Name: [2-[[(2S)-butan-2-yl]carbamoylamino]-2-oxidanylidene-ethyl] 2-[(5-bromanylfuran-2-yl)carbonylamino]ethanoate Openeye Name: [2-[[(1S)-1-methylpropyl]carbamoylamino]-2-oxo-ethyl] 2-[(5-bromofuran-2-carbonyl)amino]acetate CAS Name: 2-[[(5-bromo-2-furanyl)-oxomethyl]amino]acetic acid [2-[[[[(2S)-butan-2-yl]amino]-oxomethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-[[(2S)-butan-2-yl]carbamoylamino]-2-oxoethyl] 2-[(5-bromofuran-2-carbonyl)amino]acetate Traditional Name: 2-[(5-bromo-2-furoyl)amino]acetic acid [2-keto-2-[[(1S)-1-methylpropyl]carbamoylamino]ethyl] ester Formula: C14H18BrN3O6 MolecularWeight: 404.21322

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)NC(=O)COC(=O)CNC(=O)C1=CC=C(O1)Br

Isomeric SMILES

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

InChI

InChI=1S/C14H18BrN3O6/c1-3-8(2)17-14(22)18-11(19)7-23-12(20)6-16-13(21)9-4-5-10(15)24-9/h4-5,8H,3,6-7H2,1-2H3,(H,16,21)(H2,17,18,19,22)/t8-/m0/s1