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

Systemtic Name: 5-[(2-oxidanyl-3-prop-2-enyl-phenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-[(3-allyl-2-hydroxy-phenyl)methylene]-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-[(2-hydroxy-3-prop-2-enylphenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-[(2-hydroxy-3-prop-2-enylphenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-(3-allyl-2-hydroxy-benzylidene)-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C14H12N2O3S MolecularWeight: 288.32168

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC1=CC=CC(=C1O)C=C2C(=O)NC(=S)NC2=O

Isomeric SMILES

C=CCC1=CC=CC(=C1O)C=C2C(=O)NC(=S)NC2=O

InChI

InChI=1S/C14H12N2O3S/c1-2-4-8-5-3-6-9(11(8)17)7-10-12(18)15-14(20)16-13(10)19/h2-3,5-7,17H,1,4H2,(H2,15,16,18,19,20)