1-[2,5-bis(bromanyl)phenyl]sulfonyl-3-(4,6-dimethoxypyrimidin-2-yl)urea

Systemtic Name: 1-[2,5-bis(bromanyl)phenyl]sulfonyl-3-(4,6-dimethoxypyrimidin-2-yl)urea Openeye Name: 1-(2,5-dibromophenyl)sulfonyl-3-(4,6-dimethoxypyrimidin-2-yl)urea CAS Name: 1-(2,5-dibromophenyl)sulfonyl-3-(4,6-dimethoxy-2-pyrimidinyl)urea IUPAC Name: 1-(2,5-dibromophenyl)sulfonyl-3-(4,6-dimethoxypyrimidin-2-yl)urea Traditional Name: 1-(2,5-dibromophenyl)sulfonyl-3-(4,6-dimethoxypyrimidin-2-yl)urea Formula: C13H12Br2N4O5S MolecularWeight: 496.13118

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=NC(=N1)NC(=O)NS(=O)(=O)C2=C(C=CC(=C2)Br)Br)OC

Isomeric SMILES

COC1=CC(=NC(=N1)NC(=O)NS(=O)(=O)C2=C(C=CC(=C2)Br)Br)OC

InChI

InChI=1S/C13H12Br2N4O5S/c1-23-10-6-11(24-2)17-12(16-10)18-13(20)19-25(21,22)9-5-7(14)3-4-8(9)15/h3-6H,1-2H3,(H2,16,17,18,19,20)