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

Systemtic Name: (2S)-2-[(5-cyclopropyl-4-methyl-1,2,4-triazol-3-yl)sulfanyl]propanoic acid Openeye Name: (2S)-2-[(5-cyclopropyl-4-methyl-1,2,4-triazol-3-yl)sulfanyl]propanoic acid CAS Name: (2S)-2-[(5-cyclopropyl-4-methyl-1,2,4-triazol-3-yl)thio]propanoic acid IUPAC Name: (2S)-2-[(5-cyclopropyl-4-methyl-1,2,4-triazol-3-yl)sulfanyl]propanoic acid Traditional Name: (2S)-2-[(5-cyclopropyl-4-methyl-1,2,4-triazol-3-yl)thio]propionic acid Formula: C9H13N3O2S MolecularWeight: 227.28342

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)SC1=NN=C(N1C)C2CC2

Isomeric SMILES

C[C@@H](C(=O)O)SC1=NN=C(N1C)C2CC2

InChI

InChI=1S/C9H13N3O2S/c1-5(8(13)14)15-9-11-10-7(12(9)2)6-3-4-6/h5-6H,3-4H2,1-2H3,(H,13,14)/t5-/m0/s1