3-[2-[[2-(pyridin-2-ylamino)-1,3-oxazol-4-yl]carbonylamino]propanoylamino]pent-4-ynoic acid

Systemtic Name: 3-[2-[[2-(pyridin-2-ylamino)-1,3-oxazol-4-yl]carbonylamino]propanoylamino]pent-4-ynoic acid Openeye Name: 3-[2-[[2-(2-pyridylamino)oxazole-4-carbonyl]amino]propanoylamino]pent-4-ynoic acid CAS Name: 3-[[1-oxo-2-[[oxo-[2-(2-pyridinylamino)-4-oxazolyl]methyl]amino]propyl]amino]-4-pentynoic acid IUPAC Name: 3-[2-[[2-(pyridin-2-ylamino)-1,3-oxazole-4-carbonyl]amino]propanoylamino]pent-4-ynoic acid Traditional Name: 3-[2-[[2-(2-pyridylamino)oxazole-4-carbonyl]amino]propanoylamino]pent-4-ynoic acid Formula: C17H17N5O5 MolecularWeight: 371.34738

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(CC(=O)O)C#C)NC(=O)C1=COC(=N1)NC2=CC=CC=N2

Isomeric SMILES

CC(C(=O)NC(CC(=O)O)C#C)NC(=O)C1=COC(=N1)NC2=CC=CC=N2

InChI

InChI=1S/C17H17N5O5/c1-3-11(8-14(23)24)20-15(25)10(2)19-16(26)12-9-27-17(21-12)22-13-6-4-5-7-18-13/h1,4-7,9-11H,8H2,2H3,(H,19,26)(H,20,25)(H,23,24)(H,18,21,22)