5-ethyl-2-[1-(4-fluoranyl-3-nitro-phenyl)-2,5-bis(oxidanylidene)pyrrolidin-3-yl]sulfanyl-1H-pyrimidine-4,6-dione

Systemtic Name: 5-ethyl-2-[1-(4-fluoranyl-3-nitro-phenyl)-2,5-bis(oxidanylidene)pyrrolidin-3-yl]sulfanyl-1H-pyrimidine-4,6-dione Openeye Name: 5-ethyl-2-[1-(4-fluoro-3-nitro-phenyl)-2,5-dioxo-pyrrolidin-3-yl]sulfanyl-1H-pyrimidine-4,6-dione CAS Name: 5-ethyl-2-[[1-(4-fluoro-3-nitrophenyl)-2,5-dioxo-3-pyrrolidinyl]thio]-1H-pyrimidine-4,6-dione IUPAC Name: 5-ethyl-2-[1-(4-fluoro-3-nitrophenyl)-2,5-dioxopyrrolidin-3-yl]sulfanyl-1H-pyrimidine-4,6-dione Traditional Name: 5-ethyl-2-[[1-(4-fluoro-3-nitro-phenyl)-2,5-diketo-pyrrolidin-3-yl]thio]-1H-pyrimidine-4,6-quinone Formula: C16H13FN4O6S MolecularWeight: 408.361023

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=O)NC(=NC1=O)SC2CC(=O)N(C2=O)C3=CC(=C(C=C3)F)[N+](=O)[O-]

Isomeric SMILES

CCC1C(=O)NC(=NC1=O)SC2CC(=O)N(C2=O)C3=CC(=C(C=C3)F)[N+](=O)[O-]

InChI

InChI=1S/C16H13FN4O6S/c1-2-8-13(23)18-16(19-14(8)24)28-11-6-12(22)20(15(11)25)7-3-4-9(17)10(5-7)21(26)27/h3-5,8,11H,2,6H2,1H3,(H,18,19,23,24)