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

Systemtic Name: 2-[3-[5-fluoranyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]-3-sulfanyl-propyl]isoindole-1,3-dione Openeye Name: 2-[3-(5-fluoro-2,4-dioxo-pyrimidin-1-yl)-3-sulfanyl-propyl]isoindoline-1,3-dione CAS Name: 2-[3-(5-fluoro-2,4-dioxo-1-pyrimidinyl)-3-mercaptopropyl]isoindole-1,3-dione IUPAC Name: 2-[3-(5-fluoro-2,4-dioxopyrimidin-1-yl)-3-sulfanylpropyl]isoindole-1,3-dione Traditional Name: 2-[3-(5-fluoro-2,4-diketo-pyrimidin-1-yl)-3-mercapto-propyl]isoindoline-1,3-quinone Formula: C15H12FN3O4S MolecularWeight: 349.336883

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CCC(N3C=C(C(=O)NC3=O)F)S

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CCC(N3C=C(C(=O)NC3=O)F)S

InChI

InChI=1S/C15H12FN3O4S/c16-10-7-19(15(23)17-12(10)20)11(24)5-6-18-13(21)8-3-1-2-4-9(8)14(18)22/h1-4,7,11,24H,5-6H2,(H,17,20,23)