methyl 3-[3-[5-(phenylmethoxycarbonylamino)thiophen-2-yl]-1,2,4-oxadiazol-5-yl]propanoate

Systemtic Name: methyl 3-[3-[5-(phenylmethoxycarbonylamino)thiophen-2-yl]-1,2,4-oxadiazol-5-yl]propanoate Openeye Name: methyl 3-[3-[5-(benzyloxycarbonylamino)-2-thienyl]-1,2,4-oxadiazol-5-yl]propanoate CAS Name: 3-[3-[5-(phenylmethoxycarbonylamino)-2-thiophenyl]-1,2,4-oxadiazol-5-yl]propanoic acid methyl ester IUPAC Name: methyl 3-[3-[5-(phenylmethoxycarbonylamino)thiophen-2-yl]-1,2,4-oxadiazol-5-yl]propanoate Traditional Name: 3-[3-[5-(benzyloxycarbonylamino)-2-thienyl]-1,2,4-oxadiazol-5-yl]propionic acid methyl ester Formula: C18H17N3O5S MolecularWeight: 387.40968

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC1=NC(=NO1)C2=CC=C(S2)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

COC(=O)CCC1=NC(=NO1)C2=CC=C(S2)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C18H17N3O5S/c1-24-16(22)10-8-14-19-17(21-26-14)13-7-9-15(27-13)20-18(23)25-11-12-5-3-2-4-6-12/h2-7,9H,8,10-11H2,1H3,(H,20,23)