3-[3-[5-(ethoxycarbonylamino)thiophen-3-yl]-1,2,4-oxadiazol-5-yl]propanoic acid

Systemtic Name: 3-[3-[5-(ethoxycarbonylamino)thiophen-3-yl]-1,2,4-oxadiazol-5-yl]propanoic acid Openeye Name: 3-[3-[5-(ethoxycarbonylamino)-3-thienyl]-1,2,4-oxadiazol-5-yl]propanoic acid CAS Name: 3-[3-[5-(ethoxycarbonylamino)-3-thiophenyl]-1,2,4-oxadiazol-5-yl]propanoic acid IUPAC Name: 3-[3-[5-(ethoxycarbonylamino)thiophen-3-yl]-1,2,4-oxadiazol-5-yl]propanoic acid Traditional Name: 3-[3-[5-(carbethoxyamino)-3-thienyl]-1,2,4-oxadiazol-5-yl]propionic acid Formula: C12H13N3O5S MolecularWeight: 311.31372

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC1=CC(=CS1)C2=NOC(=N2)CCC(=O)O

Isomeric SMILES

CCOC(=O)NC1=CC(=CS1)C2=NOC(=N2)CCC(=O)O

InChI

InChI=1S/C12H13N3O5S/c1-2-19-12(18)14-9-5-7(6-21-9)11-13-8(20-15-11)3-4-10(16)17/h5-6H,2-4H2,1H3,(H,14,18)(H,16,17)