ethyl 4-[2-(4-ethoxyphenyl)ethylamino]-2,6-dimethyl-furo[2,3-d]pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-[2-(4-ethoxyphenyl)ethylamino]-2,6-dimethyl-furo[2,3-d]pyrimidine-5-carboxylate Openeye Name: ethyl 4-[2-(4-ethoxyphenyl)ethylamino]-2,6-dimethyl-furo[2,3-d]pyrimidine-5-carboxylate CAS Name: 4-[2-(4-ethoxyphenyl)ethylamino]-2,6-dimethyl-5-furo[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-(4-ethoxyphenyl)ethylamino]-2,6-dimethylfuro[2,3-d]pyrimidine-5-carboxylate Traditional Name: 2,6-dimethyl-4-(2-p-phenetylethylamino)furo[2,3-d]pyrimidine-5-carboxylic acid ethyl ester Formula: C21H25N3O4 MolecularWeight: 383.4409

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)CCNC2=C3C(=C(OC3=NC(=N2)C)C)C(=O)OCC

Isomeric SMILES

CCOC1=CC=C(C=C1)CCNC2=C3C(=C(OC3=NC(=N2)C)C)C(=O)OCC

InChI

InChI=1S/C21H25N3O4/c1-5-26-16-9-7-15(8-10-16)11-12-22-19-18-17(21(25)27-6-2)13(3)28-20(18)24-14(4)23-19/h7-10H,5-6,11-12H2,1-4H3,(H,22,23,24)