ethyl 5-[2-[(2-chloranyl-4-fluoranyl-phenyl)amino]-2-oxidanylidene-ethyl]-4-oxidanylidene-[1,2]oxazolo[5,4-d]pyrimidine-3-carboxylate

Systemtic Name: ethyl 5-[2-[(2-chloranyl-4-fluoranyl-phenyl)amino]-2-oxidanylidene-ethyl]-4-oxidanylidene-[1,2]oxazolo[5,4-d]pyrimidine-3-carboxylate Openeye Name: ethyl 5-[2-(2-chloro-4-fluoro-anilino)-2-oxo-ethyl]-4-oxo-isoxazolo[5,4-d]pyrimidine-3-carboxylate CAS Name: 5-[2-(2-chloro-4-fluoroanilino)-2-oxoethyl]-4-oxo-3-isoxazolo[5,4-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[2-(2-chloro-4-fluoroanilino)-2-oxoethyl]-4-oxo-[1,2]oxazolo[5,4-d]pyrimidine-3-carboxylate Traditional Name: 5-[2-(2-chloro-4-fluoro-anilino)-2-keto-ethyl]-4-keto-isoxazolo[5,4-d]pyrimidine-3-carboxylic acid ethyl ester Formula: C16H12ClFN4O5 MolecularWeight: 394.741683

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NOC2=C1C(=O)N(C=N2)CC(=O)NC3=C(C=C(C=C3)F)Cl

Isomeric SMILES

CCOC(=O)C1=NOC2=C1C(=O)N(C=N2)CC(=O)NC3=C(C=C(C=C3)F)Cl

InChI

InChI=1S/C16H12ClFN4O5/c1-2-26-16(25)13-12-14(27-21-13)19-7-22(15(12)24)6-11(23)20-10-4-3-8(18)5-9(10)17/h3-5,7H,2,6H2,1H3,(H,20,23)