5-[4-(4-fluorophenyl)-4-oxidanylidene-butyl]-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 5-[4-(4-fluorophenyl)-4-oxidanylidene-butyl]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-[4-(4-fluorophenyl)-4-oxo-butyl]-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-[4-(4-fluorophenyl)-4-oxobutyl]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-[4-(4-fluorophenyl)-4-oxobutyl]-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-[4-(4-fluorophenyl)-4-keto-butyl]-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C14H13FN2O3S MolecularWeight: 308.328023

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)CCCC2C(=O)NC(=S)NC2=O)F

Isomeric SMILES

C1=CC(=CC=C1C(=O)CCCC2C(=O)NC(=S)NC2=O)F

InChI

InChI=1S/C14H13FN2O3S/c15-9-6-4-8(5-7-9)11(18)3-1-2-10-12(19)16-14(21)17-13(10)20/h4-7,10H,1-3H2,(H2,16,17,19,20,21)