(2S)-2-[(5-tert-butyl-4-methyl-1,2,4-triazol-3-yl)sulfanyl]propanoic acid

Systemtic Name: (2S)-2-[(5-tert-butyl-4-methyl-1,2,4-triazol-3-yl)sulfanyl]propanoic acid Openeye Name: (2S)-2-[(5-tert-butyl-4-methyl-1,2,4-triazol-3-yl)sulfanyl]propanoic acid CAS Name: (2S)-2-[(5-tert-butyl-4-methyl-1,2,4-triazol-3-yl)thio]propanoic acid IUPAC Name: (2S)-2-[(5-tert-butyl-4-methyl-1,2,4-triazol-3-yl)sulfanyl]propanoic acid Traditional Name: (2S)-2-[(5-tert-butyl-4-methyl-1,2,4-triazol-3-yl)thio]propionic acid Formula: C10H17N3O2S MolecularWeight: 243.32588

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)SC1=NN=C(N1C)C(C)(C)C

Isomeric SMILES

C[C@@H](C(=O)O)SC1=NN=C(N1C)C(C)(C)C

InChI

InChI=1S/C10H17N3O2S/c1-6(7(14)15)16-9-12-11-8(13(9)5)10(2,3)4/h6H,1-5H3,(H,14,15)/t6-/m0/s1