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

Systemtic Name: (5E)-5-[(5-bromanyl-3-methoxy-2-oxidanyl-phenyl)methylidene]-1-(3-ethoxyphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: (5E)-5-[(5-bromo-2-hydroxy-3-methoxy-phenyl)methylene]-1-(3-ethoxyphenyl)-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: (5E)-5-[(5-bromo-2-hydroxy-3-methoxyphenyl)methylidene]-1-(3-ethoxyphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: (5E)-5-[(5-bromo-2-hydroxy-3-methoxyphenyl)methylidene]-1-(3-ethoxyphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: (5E)-5-(5-bromo-2-hydroxy-3-methoxy-benzylidene)-1-m-phenetyl-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C20H17BrN2O5S MolecularWeight: 477.32838

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)N2C(=O)C(=CC3=CC(=CC(=C3O)OC)Br)C(=O)NC2=S

Isomeric SMILES

CCOC1=CC=CC(=C1)N2C(=O)/C(=C/C3=CC(=CC(=C3O)OC)Br)/C(=O)NC2=S

InChI

InChI=1S/C20H17BrN2O5S/c1-3-28-14-6-4-5-13(10-14)23-19(26)15(18(25)22-20(23)29)8-11-7-12(21)9-16(27-2)17(11)24/h4-10,24H,3H2,1-2H3,(H,22,25,29)/b15-8+