2-(2-azanyl-1,3-thiazol-4-yl)ethanoate; iron(3+)

Systemtic Name: 2-(2-azanyl-1,3-thiazol-4-yl)ethanoate; iron(3+) Openeye Name: ferric 2-(2-aminothiazol-4-yl)acetate CAS Name: 2-(2-amino-4-thiazolyl)acetate; iron(3+) IUPAC Name: 2-(2-amino-1,3-thiazol-4-yl)acetate; iron(3+) Traditional Name: ferric 2-(2-aminothiazol-4-yl)acetate Formula: C15H15FeN6O6S3 MolecularWeight: 527.3562

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(N=C(S1)N)CC(=O)[O-].C1=C(N=C(S1)N)CC(=O)[O-].C1=C(N=C(S1)N)CC(=O)[O-].[Fe+3]

Isomeric SMILES

C1=C(N=C(S1)N)CC(=O)[O-].C1=C(N=C(S1)N)CC(=O)[O-].C1=C(N=C(S1)N)CC(=O)[O-].[Fe+3]

InChI

InChI=1S/3C5H6N2O2S.Fe/c3*6-5-7-3(2-10-5)1-4(8)9;/h3*2H,1H2,(H2,6,7)(H,8,9);/q;;;+3/p-3