[5-(2-cyano-5-ethyl-1,3-thiazol-4-yl)furan-3-yl]phosphonic acid

Systemtic Name: [5-(2-cyano-5-ethyl-1,3-thiazol-4-yl)furan-3-yl]phosphonic acid Openeye Name: [5-(2-cyano-5-ethyl-thiazol-4-yl)-3-furyl]phosphonic acid CAS Name: [5-(2-cyano-5-ethyl-4-thiazolyl)-3-furanyl]phosphonic acid IUPAC Name: [5-(2-cyano-5-ethyl-1,3-thiazol-4-yl)furan-3-yl]phosphonic acid Traditional Name: [5-(2-cyano-5-ethyl-thiazol-4-yl)-3-furyl]phosphonic acid Formula: C10H9N2O4PS MolecularWeight: 284.228221

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N=C(S1)C#N)C2=CC(=CO2)P(=O)(O)O

Isomeric SMILES

CCC1=C(N=C(S1)C#N)C2=CC(=CO2)P(=O)(O)O

InChI

InChI=1S/C10H9N2O4PS/c1-2-8-10(12-9(4-11)18-8)7-3-6(5-16-7)17(13,14)15/h3,5H,2H2,1H3,(H2,13,14,15)