(3-propan-2-yl-1,2,4-thiadiazol-5-yl)methylphosphonic acid

Systemtic Name: (3-propan-2-yl-1,2,4-thiadiazol-5-yl)methylphosphonic acid Openeye Name: (3-isopropyl-1,2,4-thiadiazol-5-yl)methylphosphonic acid CAS Name: (3-propan-2-yl-1,2,4-thiadiazol-5-yl)methylphosphonic acid IUPAC Name: (3-propan-2-yl-1,2,4-thiadiazol-5-yl)methylphosphonic acid Traditional Name: (3-isopropyl-1,2,4-thiadiazol-5-yl)methylphosphonic acid Formula: C6H11N2O3PS MolecularWeight: 222.201901

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NSC(=N1)CP(=O)(O)O

Isomeric SMILES

CC(C)C1=NSC(=N1)CP(=O)(O)O

InChI

InChI=1S/C6H11N2O3PS/c1-4(2)6-7-5(13-8-6)3-12(9,10)11/h4H,3H2,1-2H3,(H2,9,10,11)