(5E)-1-(2-fluorophenyl)-5-[[5-(4-methyl-3-nitro-phenyl)furan-2-yl]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: (5E)-1-(2-fluorophenyl)-5-[[5-(4-methyl-3-nitro-phenyl)furan-2-yl]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: (5E)-1-(2-fluorophenyl)-5-[[5-(4-methyl-3-nitro-phenyl)-2-furyl]methylene]-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: (5E)-1-(2-fluorophenyl)-5-[[5-(4-methyl-3-nitrophenyl)-2-furanyl]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: (5E)-1-(2-fluorophenyl)-5-[[5-(4-methyl-3-nitrophenyl)furan-2-yl]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: (5E)-1-(2-fluorophenyl)-5-[[5-(4-methyl-3-nitro-phenyl)-2-furyl]methylene]-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C22H14FN3O5S MolecularWeight: 451.427063

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=CC=C(O2)C=C3C(=O)NC(=S)N(C3=O)C4=CC=CC=C4F)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C2=CC=C(O2)/C=C/3\C(=O)NC(=S)N(C3=O)C4=CC=CC=C4F)[N+](=O)[O-]

InChI

InChI=1S/C22H14FN3O5S/c1-12-6-7-13(10-18(12)26(29)30)19-9-8-14(31-19)11-15-20(27)24-22(32)25(21(15)28)17-5-3-2-4-16(17)23/h2-11H,1H3,(H,24,27,32)/b15-11+