ethyl 2-[6-azanyl-1-(4-fluorophenyl)-4-oxidanylidene-pyrimidin-2-yl]sulfanylethanoate

Systemtic Name: ethyl 2-[6-azanyl-1-(4-fluorophenyl)-4-oxidanylidene-pyrimidin-2-yl]sulfanylethanoate Openeye Name: ethyl 2-[6-amino-1-(4-fluorophenyl)-4-oxo-pyrimidin-2-yl]sulfanylacetate CAS Name: 2-[[6-amino-1-(4-fluorophenyl)-4-oxo-2-pyrimidinyl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[6-amino-1-(4-fluorophenyl)-4-oxopyrimidin-2-yl]sulfanylacetate Traditional Name: 2-[[6-amino-1-(4-fluorophenyl)-4-keto-pyrimidin-2-yl]thio]acetic acid ethyl ester Formula: C14H14FN3O3S MolecularWeight: 323.342663

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=NC(=O)C=C(N1C2=CC=C(C=C2)F)N

Isomeric SMILES

CCOC(=O)CSC1=NC(=O)C=C(N1C2=CC=C(C=C2)F)N

InChI

InChI=1S/C14H14FN3O3S/c1-2-21-13(20)8-22-14-17-12(19)7-11(16)18(14)10-5-3-9(15)4-6-10/h3-7H,2,8,16H2,1H3