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

Systemtic Name: (5E)-5-[(3-bromanyl-4-oxidanyl-phenyl)methylidene]-1-prop-2-enyl-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: (5E)-1-allyl-5-[(3-bromo-4-hydroxy-phenyl)methylene]-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: (5E)-5-[(3-bromo-4-hydroxyphenyl)methylidene]-1-prop-2-enyl-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: (5E)-5-[(3-bromo-4-hydroxyphenyl)methylidene]-1-prop-2-enyl-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: (5E)-1-allyl-5-(3-bromo-4-hydroxy-benzylidene)-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C14H11BrN2O3S MolecularWeight: 367.21774

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)C(=CC2=CC(=C(C=C2)O)Br)C(=O)NC1=S

Isomeric SMILES

C=CCN1C(=O)/C(=C/C2=CC(=C(C=C2)O)Br)/C(=O)NC1=S

InChI

InChI=1S/C14H11BrN2O3S/c1-2-5-17-13(20)9(12(19)16-14(17)21)6-8-3-4-11(18)10(15)7-8/h2-4,6-7,18H,1,5H2,(H,16,19,21)/b9-6+