5-[(4-bromanyl-5-phenylsulfanyl-furan-2-yl)methylidene]-1-(furan-2-ylmethyl)-1,3-diazinane-2,4,6-trione

Systemtic Name: 5-[(4-bromanyl-5-phenylsulfanyl-furan-2-yl)methylidene]-1-(furan-2-ylmethyl)-1,3-diazinane-2,4,6-trione Openeye Name: 5-[(4-bromo-5-phenylsulfanyl-2-furyl)methylene]-1-(2-furylmethyl)hexahydropyrimidine-2,4,6-trione CAS Name: 5-[[4-bromo-5-(phenylthio)-2-furanyl]methylidene]-1-(2-furanylmethyl)-1,3-diazinane-2,4,6-trione IUPAC Name: 5-[(4-bromo-5-phenylsulfanylfuran-2-yl)methylidene]-1-(furan-2-ylmethyl)-1,3-diazinane-2,4,6-trione Traditional Name: 5-[[4-bromo-5-(phenylthio)-2-furyl]methylene]-1-(2-furfuryl)barbituric acid Formula: C20H13BrN2O5S MolecularWeight: 473.29662

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SC2=C(C=C(O2)C=C3C(=O)NC(=O)N(C3=O)CC4=CC=CO4)Br

Isomeric SMILES

C1=CC=C(C=C1)SC2=C(C=C(O2)C=C3C(=O)NC(=O)N(C3=O)CC4=CC=CO4)Br

InChI

InChI=1S/C20H13BrN2O5S/c21-16-10-13(28-19(16)29-14-6-2-1-3-7-14)9-15-17(24)22-20(26)23(18(15)25)11-12-5-4-8-27-12/h1-10H,11H2,(H,22,24,26)