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

Systemtic Name: ethyl 3-[[5-(5-nitrofuran-2-yl)-1,3,4-thiadiazol-2-yl]sulfanyl]propanoate Openeye Name: ethyl 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 ethyl ester IUPAC Name: ethyl 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 ethyl ester Formula: C11H11N3O5S2 MolecularWeight: 329.35214

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H11N3O5S2/c1-2-18-9(15)5-6-20-11-13-12-10(21-11)7-3-4-8(19-7)14(16)17/h3-4H,2,5-6H2,1H3