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

Systemtic Name: 2-cyclopropyl-2-[2-[(4-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]propanoic acid Openeye Name: 2-cyclopropyl-2-[[2-[(4-isopropyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]propanoic acid CAS Name: 2-cyclopropyl-2-[[1-oxo-2-[(4-propan-2-yl-1,2,4-triazol-3-yl)thio]ethyl]amino]propanoic acid IUPAC Name: 2-cyclopropyl-2-[[2-[(4-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]propanoic acid Traditional Name: 2-cyclopropyl-2-[[2-[(4-isopropyl-1,2,4-triazol-3-yl)thio]acetyl]amino]propionic acid Formula: C13H20N4O3S MolecularWeight: 312.3879

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=NN=C1SCC(=O)NC(C)(C2CC2)C(=O)O

Isomeric SMILES

CC(C)N1C=NN=C1SCC(=O)NC(C)(C2CC2)C(=O)O

InChI

InChI=1S/C13H20N4O3S/c1-8(2)17-7-14-16-12(17)21-6-10(18)15-13(3,11(19)20)9-4-5-9/h7-9H,4-6H2,1-3H3,(H,15,18)(H,19,20)