[2-azanyl-5-(1-cyanobutyl)-1,3-thiazol-4-yl]carbonyloxymethylphosphonic acid

Systemtic Name: [2-azanyl-5-(1-cyanobutyl)-1,3-thiazol-4-yl]carbonyloxymethylphosphonic acid Openeye Name: [2-amino-5-(1-cyanobutyl)thiazole-4-carbonyl]oxymethylphosphonic acid CAS Name: [[2-amino-5-(1-cyanobutyl)-4-thiazolyl]-oxomethoxy]methylphosphonic acid IUPAC Name: [2-amino-5-(1-cyanobutyl)-1,3-thiazole-4-carbonyl]oxymethylphosphonic acid Traditional Name: [2-amino-5-(1-cyanobutyl)thiazole-4-carbonyl]oxymethylphosphonic acid Formula: C10H14N3O5PS MolecularWeight: 319.274021

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C#N)C1=C(N=C(S1)N)C(=O)OCP(=O)(O)O

Isomeric SMILES

CCCC(C#N)C1=C(N=C(S1)N)C(=O)OCP(=O)(O)O

InChI

InChI=1S/C10H14N3O5PS/c1-2-3-6(4-11)8-7(13-10(12)20-8)9(14)18-5-19(15,16)17/h6H,2-3,5H2,1H3,(H2,12,13)(H2,15,16,17)