4-fluoranyl-N-[2-(2-methoxyethylsulfanyl)-4-oxidanylidene-6-(propanoylamino)-1H-pyrimidin-5-yl]benzamide

Systemtic Name: 4-fluoranyl-N-[2-(2-methoxyethylsulfanyl)-4-oxidanylidene-6-(propanoylamino)-1H-pyrimidin-5-yl]benzamide Openeye Name: 4-fluoro-N-[2-(2-methoxyethylsulfanyl)-4-oxo-6-(propanoylamino)-1H-pyrimidin-5-yl]benzamide CAS Name: 4-fluoro-N-[2-(2-methoxyethylthio)-4-oxo-6-(1-oxopropylamino)-1H-pyrimidin-5-yl]benzamide IUPAC Name: 4-fluoro-N-[2-(2-methoxyethylsulfanyl)-4-oxo-6-(propanoylamino)-1H-pyrimidin-5-yl]benzamide Traditional Name: 4-fluoro-N-[4-keto-2-(2-methoxyethylthio)-6-propionamido-1H-pyrimidin-5-yl]benzamide Formula: C17H19FN4O4S MolecularWeight: 394.420563

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=C(C(=O)N=C(N1)SCCOC)NC(=O)C2=CC=C(C=C2)F

Isomeric SMILES

CCC(=O)NC1=C(C(=O)N=C(N1)SCCOC)NC(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C17H19FN4O4S/c1-3-12(23)19-14-13(16(25)22-17(21-14)27-9-8-26-2)20-15(24)10-4-6-11(18)7-5-10/h4-7H,3,8-9H2,1-2H3,(H,20,24)(H2,19,21,22,23,25)