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

Systemtic Name: [(4-ethyl-1,3-thiazol-2-yl)-phosphono-methyl]phosphonic acid Openeye Name: [(4-ethylthiazol-2-yl)-phosphono-methyl]phosphonic acid CAS Name: [(4-ethyl-2-thiazolyl)-phosphonomethyl]phosphonic acid IUPAC Name: [(4-ethyl-1,3-thiazol-2-yl)-phosphonomethyl]phosphonic acid Traditional Name: [(4-ethylthiazol-2-yl)-phosphono-methyl]phosphonic acid Formula: C6H11NO6P2S MolecularWeight: 287.167162

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CSC(=N1)C(P(=O)(O)O)P(=O)(O)O

Isomeric SMILES

CCC1=CSC(=N1)C(P(=O)(O)O)P(=O)(O)O

InChI

InChI=1S/C6H11NO6P2S/c1-2-4-3-16-5(7-4)6(14(8,9)10)15(11,12)13/h3,6H,2H2,1H3,(H2,8,9,10)(H2,11,12,13)