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

Systemtic Name: (5E)-5-[[5-(4-nitrophenyl)furan-2-yl]methylidene]-1-phenyl-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: (5E)-5-[[5-(4-nitrophenyl)-2-furyl]methylene]-1-phenyl-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: (5E)-5-[[5-(4-nitrophenyl)-2-furanyl]methylidene]-1-phenyl-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: (5E)-5-[[5-(4-nitrophenyl)furan-2-yl]methylidene]-1-phenyl-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: (5E)-5-[[5-(4-nitrophenyl)-2-furyl]methylene]-1-phenyl-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C21H13N3O5S MolecularWeight: 419.41002

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=O)C(=CC3=CC=C(O3)C4=CC=C(C=C4)[N+](=O)[O-])C(=O)NC2=S

Isomeric SMILES

C1=CC=C(C=C1)N2C(=O)/C(=C/C3=CC=C(O3)C4=CC=C(C=C4)[N+](=O)[O-])/C(=O)NC2=S

InChI

InChI=1S/C21H13N3O5S/c25-19-17(20(26)23(21(30)22-19)14-4-2-1-3-5-14)12-16-10-11-18(29-16)13-6-8-15(9-7-13)24(27)28/h1-12H,(H,22,25,30)/b17-12+