(3-phenyl-1,2,4-oxadiazol-5-yl)methyl 5-fluoranyl-1-benzothiophene-2-carboxylate

Systemtic Name: (3-phenyl-1,2,4-oxadiazol-5-yl)methyl 5-fluoranyl-1-benzothiophene-2-carboxylate Openeye Name: (3-phenyl-1,2,4-oxadiazol-5-yl)methyl 5-fluorobenzothiophene-2-carboxylate CAS Name: 5-fluoro-1-benzothiophene-2-carboxylic acid (3-phenyl-1,2,4-oxadiazol-5-yl)methyl ester IUPAC Name: (3-phenyl-1,2,4-oxadiazol-5-yl)methyl 5-fluoro-1-benzothiophene-2-carboxylate Traditional Name: 5-fluorobenzothiophene-2-carboxylic acid (3-phenyl-1,2,4-oxadiazol-5-yl)methyl ester Formula: C18H11FN2O3S MolecularWeight: 354.354943

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NOC(=N2)COC(=O)C3=CC4=C(S3)C=CC(=C4)F

Isomeric SMILES

C1=CC=C(C=C1)C2=NOC(=N2)COC(=O)C3=CC4=C(S3)C=CC(=C4)F

InChI

InChI=1S/C18H11FN2O3S/c19-13-6-7-14-12(8-13)9-15(25-14)18(22)23-10-16-20-17(21-24-16)11-4-2-1-3-5-11/h1-9H,10H2