2-(2-azanylidene-5-ethyl-1,3,4-thiadiazol-3-yl)ethylsulfanylphosphonic acid

Systemtic Name: 2-(2-azanylidene-5-ethyl-1,3,4-thiadiazol-3-yl)ethylsulfanylphosphonic acid Openeye Name: 2-(5-ethyl-2-imino-1,3,4-thiadiazol-3-yl)ethylsulfanylphosphonic acid CAS Name: [2-(5-ethyl-2-imino-1,3,4-thiadiazol-3-yl)ethylthio]phosphonic acid IUPAC Name: 2-(5-ethyl-2-imino-1,3,4-thiadiazol-3-yl)ethylsulfanylphosphonic acid Traditional Name: [2-(5-ethyl-2-imino-1,3,4-thiadiazol-3-yl)ethylthio]phosphonic acid Formula: C6H12N3O3PS2 MolecularWeight: 269.281541

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN(C(=N)S1)CCSP(=O)(O)O

Isomeric SMILES

CCC1=NN(C(=N)S1)CCSP(=O)(O)O

InChI

InChI=1S/C6H12N3O3PS2/c1-2-5-8-9(6(7)15-5)3-4-14-13(10,11)12/h7H,2-4H2,1H3,(H2,10,11,12)