5-[(3-bromanyl-2-chloranyl-5-methoxy-4-oxidanyl-phenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 5-[(3-bromanyl-2-chloranyl-5-methoxy-4-oxidanyl-phenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-[(3-bromo-2-chloro-4-hydroxy-5-methoxy-phenyl)methylene]-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-[(3-bromo-2-chloro-4-hydroxy-5-methoxyphenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-[(3-bromo-2-chloro-4-hydroxy-5-methoxyphenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-(3-bromo-2-chloro-4-hydroxy-5-methoxy-benzylidene)-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C12H8BrClN2O4S MolecularWeight: 391.62492

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C(=C1)C=C2C(=O)NC(=S)NC2=O)Cl)Br)O

Isomeric SMILES

COC1=C(C(=C(C(=C1)C=C2C(=O)NC(=S)NC2=O)Cl)Br)O

InChI

InChI=1S/C12H8BrClN2O4S/c1-20-6-3-4(8(14)7(13)9(6)17)2-5-10(18)15-12(21)16-11(5)19/h2-3,17H,1H3,(H2,15,16,18,19,21)