(2S)-5-azanyl-5-oxidanylidene-2-[2-(1,2,4-triazol-1-yl)ethanoylamino]pentanoate

Systemtic Name: (2S)-5-azanyl-5-oxidanylidene-2-[2-(1,2,4-triazol-1-yl)ethanoylamino]pentanoate Openeye Name: (2S)-5-amino-5-oxo-2-[[2-(1,2,4-triazol-1-yl)acetyl]amino]pentanoate CAS Name: (2S)-5-amino-5-oxo-2-[[1-oxo-2-(1,2,4-triazol-1-yl)ethyl]amino]pentanoate IUPAC Name: (2S)-5-amino-5-oxo-2-[[2-(1,2,4-triazol-1-yl)acetyl]amino]pentanoate Traditional Name: (2S)-5-amino-5-keto-2-[[2-(1,2,4-triazol-1-yl)acetyl]amino]valerate Formula: C9H12N5O4- MolecularWeight: 254.22268

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Descriptors Computed from Structure

Canonical SMILES:

C1=NN(C=N1)CC(=O)NC(CCC(=O)N)C(=O)[O-]

Isomeric SMILES

C1=NN(C=N1)CC(=O)N[C@@H](CCC(=O)N)C(=O)[O-]

InChI

InChI=1S/C9H13N5O4/c10-7(15)2-1-6(9(17)18)13-8(16)3-14-5-11-4-12-14/h4-6H,1-3H2,(H2,10,15)(H,13,16)(H,17,18)/p-1/t6-/m0/s1