(2S)-4-methyl-2-[2-(1,2,4-triazol-1-yl)ethanoylamino]pentanoate

Systemtic Name: (2S)-4-methyl-2-[2-(1,2,4-triazol-1-yl)ethanoylamino]pentanoate Openeye Name: (2S)-4-methyl-2-[[2-(1,2,4-triazol-1-yl)acetyl]amino]pentanoate CAS Name: (2S)-4-methyl-2-[[1-oxo-2-(1,2,4-triazol-1-yl)ethyl]amino]pentanoate IUPAC Name: (2S)-4-methyl-2-[[2-(1,2,4-triazol-1-yl)acetyl]amino]pentanoate Traditional Name: (2S)-4-methyl-2-[[2-(1,2,4-triazol-1-yl)acetyl]amino]valerate Formula: C10H15N4O3- MolecularWeight: 239.2511

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)[O-])NC(=O)CN1C=NC=N1

Isomeric SMILES

CC(C)C[C@@H](C(=O)[O-])NC(=O)CN1C=NC=N1

InChI

InChI=1S/C10H16N4O3/c1-7(2)3-8(10(16)17)13-9(15)4-14-6-11-5-12-14/h5-8H,3-4H2,1-2H3,(H,13,15)(H,16,17)/p-1/t8-/m0/s1