ethyl 5-[2-[(4-fluorophenyl)methylsulfanyl]-4-oxidanylidene-5-(pyrimidin-5-ylmethyl)pyrimidin-1-yl]furan-2-carboxylate

Systemtic Name: ethyl 5-[2-[(4-fluorophenyl)methylsulfanyl]-4-oxidanylidene-5-(pyrimidin-5-ylmethyl)pyrimidin-1-yl]furan-2-carboxylate Openeye Name: ethyl 5-[2-[(4-fluorophenyl)methylsulfanyl]-4-oxo-5-(pyrimidin-5-ylmethyl)pyrimidin-1-yl]furan-2-carboxylate CAS Name: 5-[2-[(4-fluorophenyl)methylthio]-4-oxo-5-(5-pyrimidinylmethyl)-1-pyrimidinyl]-2-furancarboxylic acid ethyl ester IUPAC Name: ethyl 5-[2-[(4-fluorophenyl)methylsulfanyl]-4-oxo-5-(pyrimidin-5-ylmethyl)pyrimidin-1-yl]furan-2-carboxylate Traditional Name: 5-[2-[(4-fluorobenzyl)thio]-4-keto-5-(5-pyrimidylmethyl)pyrimidin-1-yl]furan-2-carboxylic acid ethyl ester Formula: C23H19FN4O4S MolecularWeight: 466.484763

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(O1)N2C=C(C(=O)N=C2SCC3=CC=C(C=C3)F)CC4=CN=CN=C4

Isomeric SMILES

CCOC(=O)C1=CC=C(O1)N2C=C(C(=O)N=C2SCC3=CC=C(C=C3)F)CC4=CN=CN=C4

InChI

InChI=1S/C23H19FN4O4S/c1-2-31-22(30)19-7-8-20(32-19)28-12-17(9-16-10-25-14-26-11-16)21(29)27-23(28)33-13-15-3-5-18(24)6-4-15/h3-8,10-12,14H,2,9,13H2,1H3