1-(2,4-dichlorophenyl)-5-[(3-nitro-4-oxidanyl-phenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 1-(2,4-dichlorophenyl)-5-[(3-nitro-4-oxidanyl-phenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 1-(2,4-dichlorophenyl)-5-[(4-hydroxy-3-nitro-phenyl)methylene]-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 1-(2,4-dichlorophenyl)-5-[(4-hydroxy-3-nitrophenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 1-(2,4-dichlorophenyl)-5-[(4-hydroxy-3-nitrophenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 1-(2,4-dichlorophenyl)-5-(4-hydroxy-3-nitro-benzylidene)-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C17H9Cl2N3O5S MolecularWeight: 438.24146

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C=C2C(=O)NC(=S)N(C2=O)C3=C(C=C(C=C3)Cl)Cl)[N+](=O)[O-])O

Isomeric SMILES

C1=CC(=C(C=C1C=C2C(=O)NC(=S)N(C2=O)C3=C(C=C(C=C3)Cl)Cl)[N+](=O)[O-])O

InChI

InChI=1S/C17H9Cl2N3O5S/c18-9-2-3-12(11(19)7-9)21-16(25)10(15(24)20-17(21)28)5-8-1-4-14(23)13(6-8)22(26)27/h1-7,23H,(H,20,24,28)