(2S)-2-[(5-bromanylpyridin-3-yl)carbonylamino]-3-(1H-imidazol-5-yl)propanoate

Systemtic Name: (2S)-2-[(5-bromanylpyridin-3-yl)carbonylamino]-3-(1H-imidazol-5-yl)propanoate Openeye Name: (2S)-2-[(5-bromopyridine-3-carbonyl)amino]-3-(1H-imidazol-5-yl)propanoate CAS Name: (2S)-2-[[(5-bromo-3-pyridinyl)-oxomethyl]amino]-3-(1H-imidazol-5-yl)propanoate IUPAC Name: (2S)-2-[(5-bromopyridine-3-carbonyl)amino]-3-(1H-imidazol-5-yl)propanoate Traditional Name: (2S)-2-[(5-bromonicotinoyl)amino]-3-(1H-imidazol-5-yl)propionate Formula: C12H10BrN4O3- MolecularWeight: 338.1368

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=NC=C1Br)C(=O)NC(CC2=CN=CN2)C(=O)[O-]

Isomeric SMILES

C1=C(C=NC=C1Br)C(=O)N[C@@H](CC2=CN=CN2)C(=O)[O-]

InChI

InChI=1S/C12H11BrN4O3/c13-8-1-7(3-14-4-8)11(18)17-10(12(19)20)2-9-5-15-6-16-9/h1,3-6,10H,2H2,(H,15,16)(H,17,18)(H,19,20)/p-1/t10-/m0/s1