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

Systemtic Name: 5-[(5-bromanyl-2-oxidanyl-phenyl)methylidene]-1-(3,4-dimethylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-[(5-bromo-2-hydroxy-phenyl)methylene]-1-(3,4-dimethylphenyl)-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-[(5-bromo-2-hydroxyphenyl)methylidene]-1-(3,4-dimethylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-[(5-bromo-2-hydroxyphenyl)methylidene]-1-(3,4-dimethylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-(5-bromo-2-hydroxy-benzylidene)-1-(3,4-dimethylphenyl)-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C19H15BrN2O3S MolecularWeight: 431.303

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=O)C(=CC3=C(C=CC(=C3)Br)O)C(=O)NC2=S)C

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=O)C(=CC3=C(C=CC(=C3)Br)O)C(=O)NC2=S)C

InChI

InChI=1S/C19H15BrN2O3S/c1-10-3-5-14(7-11(10)2)22-18(25)15(17(24)21-19(22)26)9-12-8-13(20)4-6-16(12)23/h3-9,23H,1-2H3,(H,21,24,26)