ethyl 4-azanyl-2-[[3-(4-fluorophenyl)-2-methylsulfanyl-imidazol-4-yl]carbonyloxymethyl]-6-methyl-furo[2,3-d]pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-azanyl-2-[[3-(4-fluorophenyl)-2-methylsulfanyl-imidazol-4-yl]carbonyloxymethyl]-6-methyl-furo[2,3-d]pyrimidine-5-carboxylate Openeye Name: ethyl 4-amino-2-[[3-(4-fluorophenyl)-2-methylsulfanyl-imidazole-4-carbonyl]oxymethyl]-6-methyl-furo[2,3-d]pyrimidine-5-carboxylate CAS Name: 4-amino-2-[[[3-(4-fluorophenyl)-2-(methylthio)-4-imidazolyl]-oxomethoxy]methyl]-6-methyl-5-furo[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-amino-2-[[3-(4-fluorophenyl)-2-methylsulfanylimidazole-4-carbonyl]oxymethyl]-6-methylfuro[2,3-d]pyrimidine-5-carboxylate Traditional Name: 4-amino-2-[[3-(4-fluorophenyl)-2-(methylthio)imidazole-4-carbonyl]oxymethyl]-6-methyl-furo[2,3-d]pyrimidine-5-carboxylic acid ethyl ester Formula: C22H20FN5O5S MolecularWeight: 485.488103

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC2=NC(=NC(=C12)N)COC(=O)C3=CN=C(N3C4=CC=C(C=C4)F)SC)C

Isomeric SMILES

CCOC(=O)C1=C(OC2=NC(=NC(=C12)N)COC(=O)C3=CN=C(N3C4=CC=C(C=C4)F)SC)C

InChI

InChI=1S/C22H20FN5O5S/c1-4-31-21(30)16-11(2)33-19-17(16)18(24)26-15(27-19)10-32-20(29)14-9-25-22(34-3)28(14)13-7-5-12(23)6-8-13/h5-9H,4,10H2,1-3H3,(H2,24,26,27)