[5-[2-azanyl-5-(cyclopropylmethoxycarbonyl)-1,3-thiazol-4-yl]furan-3-yl]phosphonic acid

Systemtic Name: [5-[2-azanyl-5-(cyclopropylmethoxycarbonyl)-1,3-thiazol-4-yl]furan-3-yl]phosphonic acid Openeye Name: [5-[2-amino-5-(cyclopropylmethoxycarbonyl)thiazol-4-yl]-3-furyl]phosphonic acid CAS Name: [5-[2-amino-5-[cyclopropylmethoxy(oxo)methyl]-4-thiazolyl]-3-furanyl]phosphonic acid IUPAC Name: [5-[2-amino-5-(cyclopropylmethoxycarbonyl)-1,3-thiazol-4-yl]furan-3-yl]phosphonic acid Traditional Name: [5-[2-amino-5-(cyclopropylmethoxycarbonyl)thiazol-4-yl]-3-furyl]phosphonic acid Formula: C12H13N2O6PS MolecularWeight: 344.280181

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1COC(=O)C2=C(N=C(S2)N)C3=CC(=CO3)P(=O)(O)O

Isomeric SMILES

C1CC1COC(=O)C2=C(N=C(S2)N)C3=CC(=CO3)P(=O)(O)O

InChI

InChI=1S/C12H13N2O6PS/c13-12-14-9(8-3-7(5-19-8)21(16,17)18)10(22-12)11(15)20-4-6-1-2-6/h3,5-6H,1-2,4H2,(H2,13,14)(H2,16,17,18)