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

Systemtic Name: ethyl 5-[2-[(3-chlorophenyl)amino]-2-oxidanylidene-ethyl]-4-oxidanylidene-[1,2]oxazolo[5,4-d]pyrimidine-3-carboxylate Openeye Name: ethyl 5-[2-(3-chloroanilino)-2-oxo-ethyl]-4-oxo-isoxazolo[5,4-d]pyrimidine-3-carboxylate CAS Name: 5-[2-(3-chloroanilino)-2-oxoethyl]-4-oxo-3-isoxazolo[5,4-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[2-(3-chloroanilino)-2-oxoethyl]-4-oxo-[1,2]oxazolo[5,4-d]pyrimidine-3-carboxylate Traditional Name: 5-[2-(3-chloroanilino)-2-keto-ethyl]-4-keto-isoxazolo[5,4-d]pyrimidine-3-carboxylic acid ethyl ester Formula: C16H13ClN4O5 MolecularWeight: 376.75122

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H13ClN4O5/c1-2-25-16(24)13-12-14(26-20-13)18-8-21(15(12)23)7-11(22)19-10-5-3-4-9(17)6-10/h3-6,8H,2,7H2,1H3,(H,19,22)