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

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

CN1C(=NN=C1SCCC(=O)O)C2CC2

Isomeric SMILES

CN1C(=NN=C1SCCC(=O)O)C2CC2

InChI

InChI=1S/C9H13N3O2S/c1-12-8(6-2-3-6)10-11-9(12)15-5-4-7(13)14/h6H,2-5H2,1H3,(H,13,14)