2-[3-[5-fluoranyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]-3-methylsulfanyl-propyl]isoindole-1,3-dione

Systemtic Name: 2-[3-[5-fluoranyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]-3-methylsulfanyl-propyl]isoindole-1,3-dione Openeye Name: 2-[3-(5-fluoro-2,4-dioxo-pyrimidin-1-yl)-3-methylsulfanyl-propyl]isoindoline-1,3-dione CAS Name: 2-[3-(5-fluoro-2,4-dioxo-1-pyrimidinyl)-3-(methylthio)propyl]isoindole-1,3-dione IUPAC Name: 2-[3-(5-fluoro-2,4-dioxopyrimidin-1-yl)-3-methylsulfanylpropyl]isoindole-1,3-dione Traditional Name: 2-[3-(5-fluoro-2,4-diketo-pyrimidin-1-yl)-3-(methylthio)propyl]isoindoline-1,3-quinone Formula: C16H14FN3O4S MolecularWeight: 363.363463

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Descriptors Computed from Structure

Canonical SMILES:

CSC(CCN1C(=O)C2=CC=CC=C2C1=O)N3C=C(C(=O)NC3=O)F

Isomeric SMILES

CSC(CCN1C(=O)C2=CC=CC=C2C1=O)N3C=C(C(=O)NC3=O)F

InChI

InChI=1S/C16H14FN3O4S/c1-25-12(20-8-11(17)13(21)18-16(20)24)6-7-19-14(22)9-4-2-3-5-10(9)15(19)23/h2-5,8,12H,6-7H2,1H3,(H,18,21,24)