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

Systemtic Name: 5-[(3-bromanyl-4-methoxy-phenyl)methylidene]-1-(4-ethoxyphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-[(3-bromo-4-methoxy-phenyl)methylene]-1-(4-ethoxyphenyl)-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-[(3-bromo-4-methoxyphenyl)methylidene]-1-(4-ethoxyphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-[(3-bromo-4-methoxyphenyl)methylidene]-1-(4-ethoxyphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-(3-bromo-4-methoxy-benzylidene)-1-p-phenetyl-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C20H17BrN2O4S MolecularWeight: 461.32898

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=O)C(=CC3=CC(=C(C=C3)OC)Br)C(=O)NC2=S

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=O)C(=CC3=CC(=C(C=C3)OC)Br)C(=O)NC2=S

InChI

InChI=1S/C20H17BrN2O4S/c1-3-27-14-7-5-13(6-8-14)23-19(25)15(18(24)22-20(23)28)10-12-4-9-17(26-2)16(21)11-12/h4-11H,3H2,1-2H3,(H,22,24,28)