2-[3-[2-(4,5-dithiophen-2-yl-1,3-oxazol-2-yl)ethyl]phenoxy]ethanoate

Systemtic Name: 2-[3-[2-(4,5-dithiophen-2-yl-1,3-oxazol-2-yl)ethyl]phenoxy]ethanoate Openeye Name: 2-[3-[2-[4,5-bis(2-thienyl)oxazol-2-yl]ethyl]phenoxy]acetate CAS Name: 2-[3-[2-(4,5-dithiophen-2-yl-2-oxazolyl)ethyl]phenoxy]acetate IUPAC Name: 2-[3-[2-(4,5-dithiophen-2-yl-1,3-oxazol-2-yl)ethyl]phenoxy]acetate Traditional Name: 2-[3-[2-[4,5-bis(2-thienyl)oxazol-2-yl]ethyl]phenoxy]acetate Formula: C21H16NO4S2- MolecularWeight: 410.48604

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OCC(=O)[O-])CCC2=NC(=C(O2)C3=CC=CS3)C4=CC=CS4

Isomeric SMILES

C1=CC(=CC(=C1)OCC(=O)[O-])CCC2=NC(=C(O2)C3=CC=CS3)C4=CC=CS4

InChI

InChI=1S/C21H17NO4S2/c23-19(24)13-25-15-5-1-4-14(12-15)8-9-18-22-20(16-6-2-10-27-16)21(26-18)17-7-3-11-28-17/h1-7,10-12H,8-9,13H2,(H,23,24)/p-1