5-azanyl-5-oxidanylidene-2-[2-(1,2,4-triazol-1-yl)propanoylamino]pentanoic acid

Systemtic Name: 5-azanyl-5-oxidanylidene-2-[2-(1,2,4-triazol-1-yl)propanoylamino]pentanoic acid Openeye Name: 5-amino-5-oxo-2-[2-(1,2,4-triazol-1-yl)propanoylamino]pentanoic acid CAS Name: 5-amino-5-oxo-2-[[1-oxo-2-(1,2,4-triazol-1-yl)propyl]amino]pentanoic acid IUPAC Name: 5-amino-5-oxo-2-[2-(1,2,4-triazol-1-yl)propanoylamino]pentanoic acid Traditional Name: 5-amino-5-keto-2-[2-(1,2,4-triazol-1-yl)propanoylamino]valeric acid Formula: C10H15N5O4 MolecularWeight: 269.2572

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(CCC(=O)N)C(=O)O)N1C=NC=N1

Isomeric SMILES

CC(C(=O)NC(CCC(=O)N)C(=O)O)N1C=NC=N1

InChI

InChI=1S/C10H15N5O4/c1-6(15-5-12-4-13-15)9(17)14-7(10(18)19)2-3-8(11)16/h4-7H,2-3H2,1H3,(H2,11,16)(H,14,17)(H,18,19)