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

Systemtic Name: 5-[(3-bromanyl-4-propoxy-phenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-[(3-bromo-4-propoxy-phenyl)methylene]-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-[(3-bromo-4-propoxyphenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-[(3-bromo-4-propoxyphenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-(3-bromo-4-propoxy-benzylidene)-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C14H13BrN2O3S MolecularWeight: 369.23362

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C=C2C(=O)NC(=S)NC2=O)Br

Isomeric SMILES

CCCOC1=C(C=C(C=C1)C=C2C(=O)NC(=S)NC2=O)Br

InChI

InChI=1S/C14H13BrN2O3S/c1-2-5-20-11-4-3-8(7-10(11)15)6-9-12(18)16-14(21)17-13(9)19/h3-4,6-7H,2,5H2,1H3,(H2,16,17,18,19,21)