methyl 3-[[5-(5-nitrofuran-2-yl)-1,3,4-thiadiazol-2-yl]sulfanyl]propanoate

Systemtic Name: methyl 3-[[5-(5-nitrofuran-2-yl)-1,3,4-thiadiazol-2-yl]sulfanyl]propanoate Openeye Name: methyl 3-[[5-(5-nitro-2-furyl)-1,3,4-thiadiazol-2-yl]sulfanyl]propanoate CAS Name: 3-[[5-(5-nitro-2-furanyl)-1,3,4-thiadiazol-2-yl]thio]propanoic acid methyl ester IUPAC Name: methyl 3-[[5-(5-nitrofuran-2-yl)-1,3,4-thiadiazol-2-yl]sulfanyl]propanoate Traditional Name: 3-[[5-(5-nitro-2-furyl)-1,3,4-thiadiazol-2-yl]thio]propionic acid methyl ester Formula: C10H9N3O5S2 MolecularWeight: 315.32556

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCSC1=NN=C(S1)C2=CC=C(O2)[N+](=O)[O-]

Isomeric SMILES

COC(=O)CCSC1=NN=C(S1)C2=CC=C(O2)[N+](=O)[O-]

InChI

InChI=1S/C10H9N3O5S2/c1-17-8(14)4-5-19-10-12-11-9(20-10)6-2-3-7(18-6)13(15)16/h2-3H,4-5H2,1H3