3-[2-[(4-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]propanoic acid

Systemtic Name: 3-[2-[(4-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]propanoic acid Openeye Name: 3-[[2-[(4-isopropyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]propanoic acid CAS Name: 3-[[1-oxo-2-[(4-propan-2-yl-1,2,4-triazol-3-yl)thio]ethyl]amino]propanoic acid IUPAC Name: 3-[[2-[(4-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]propanoic acid Traditional Name: 3-[[2-[(4-isopropyl-1,2,4-triazol-3-yl)thio]acetyl]amino]propionic acid Formula: C10H16N4O3S MolecularWeight: 272.32404

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=NN=C1SCC(=O)NCCC(=O)O

Isomeric SMILES

CC(C)N1C=NN=C1SCC(=O)NCCC(=O)O

InChI

InChI=1S/C10H16N4O3S/c1-7(2)14-6-12-13-10(14)18-5-8(15)11-4-3-9(16)17/h6-7H,3-5H2,1-2H3,(H,11,15)(H,16,17)