(3-cyanophenyl)methyl 3-(2-oxidanylidene-5-thiophen-2-yl-1,3,4-oxadiazol-3-yl)propanoate

Systemtic Name: (3-cyanophenyl)methyl 3-(2-oxidanylidene-5-thiophen-2-yl-1,3,4-oxadiazol-3-yl)propanoate Openeye Name: (3-cyanophenyl)methyl 3-[2-oxo-5-(2-thienyl)-1,3,4-oxadiazol-3-yl]propanoate CAS Name: 3-(2-oxo-5-thiophen-2-yl-1,3,4-oxadiazol-3-yl)propanoic acid (3-cyanophenyl)methyl ester IUPAC Name: (3-cyanophenyl)methyl 3-(2-oxo-5-thiophen-2-yl-1,3,4-oxadiazol-3-yl)propanoate Traditional Name: 3-[2-keto-5-(2-thienyl)-1,3,4-oxadiazol-3-yl]propionic acid (3-cyanobenzyl) ester Formula: C17H13N3O4S MolecularWeight: 355.36782

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)COC(=O)CCN2C(=O)OC(=N2)C3=CC=CS3)C#N

Isomeric SMILES

C1=CC(=CC(=C1)COC(=O)CCN2C(=O)OC(=N2)C3=CC=CS3)C#N

InChI

InChI=1S/C17H13N3O4S/c18-10-12-3-1-4-13(9-12)11-23-15(21)6-7-20-17(22)24-16(19-20)14-5-2-8-25-14/h1-5,8-9H,6-7,11H2