tert-butyl (2S)-2-[[5-(methylcarbamoyl)-1H-imidazol-4-yl]carbonylamino]propanoate

Systemtic Name: tert-butyl (2S)-2-[[5-(methylcarbamoyl)-1H-imidazol-4-yl]carbonylamino]propanoate Openeye Name: tert-butyl (2S)-2-[[5-(methylcarbamoyl)-1H-imidazole-4-carbonyl]amino]propanoate CAS Name: (2S)-2-[[[5-(methylcarbamoyl)-1H-imidazol-4-yl]-oxomethyl]amino]propanoic acid tert-butyl ester IUPAC Name: tert-butyl (2S)-2-[[5-(methylcarbamoyl)-1H-imidazole-4-carbonyl]amino]propanoate Traditional Name: (2S)-2-[[5-(methylcarbamoyl)-1H-imidazole-4-carbonyl]amino]propionic acid tert-butyl ester Formula: C13H20N4O4 MolecularWeight: 296.3223

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC(C)(C)C)NC(=O)C1=C(NC=N1)C(=O)NC

Isomeric SMILES

C[C@@H](C(=O)OC(C)(C)C)NC(=O)C1=C(NC=N1)C(=O)NC

InChI

InChI=1S/C13H20N4O4/c1-7(12(20)21-13(2,3)4)17-11(19)9-8(10(18)14-5)15-6-16-9/h6-7H,1-5H3,(H,14,18)(H,15,16)(H,17,19)/t7-/m0/s1