[(4-methyl-1,3-thiazol-2-yl)-phosphono-methyl]phosphonic acid

Systemtic Name: [(4-methyl-1,3-thiazol-2-yl)-phosphono-methyl]phosphonic acid Openeye Name: [(4-methylthiazol-2-yl)-phosphono-methyl]phosphonic acid CAS Name: [(4-methyl-2-thiazolyl)-phosphonomethyl]phosphonic acid IUPAC Name: [(4-methyl-1,3-thiazol-2-yl)-phosphonomethyl]phosphonic acid Traditional Name: [(4-methylthiazol-2-yl)-phosphono-methyl]phosphonic acid Formula: C5H9NO6P2S MolecularWeight: 273.140582

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)C(P(=O)(O)O)P(=O)(O)O

Isomeric SMILES

CC1=CSC(=N1)C(P(=O)(O)O)P(=O)(O)O

InChI

InChI=1S/C5H9NO6P2S/c1-3-2-15-4(6-3)5(13(7,8)9)14(10,11)12/h2,5H,1H3,(H2,7,8,9)(H2,10,11,12)