1-(4,6-dimethoxypyrimidin-2-yl)-3-(2-propylsulfonylphenyl)sulfonyl-urea

Systemtic Name: 1-(4,6-dimethoxypyrimidin-2-yl)-3-(2-propylsulfonylphenyl)sulfonyl-urea Openeye Name: 1-(4,6-dimethoxypyrimidin-2-yl)-3-(2-propylsulfonylphenyl)sulfonyl-urea CAS Name: 1-(4,6-dimethoxy-2-pyrimidinyl)-3-(2-propylsulfonylphenyl)sulfonylurea IUPAC Name: 1-(4,6-dimethoxypyrimidin-2-yl)-3-(2-propylsulfonylphenyl)sulfonylurea Traditional Name: 1-(4,6-dimethoxypyrimidin-2-yl)-3-(2-propylsulfonylphenyl)sulfonyl-urea Formula: C16H20N4O7S2 MolecularWeight: 444.4826

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)C1=CC=CC=C1S(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC

Isomeric SMILES

CCCS(=O)(=O)C1=CC=CC=C1S(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC

InChI

InChI=1S/C16H20N4O7S2/c1-4-9-28(22,23)11-7-5-6-8-12(11)29(24,25)20-16(21)19-15-17-13(26-2)10-14(18-15)27-3/h5-8,10H,4,9H2,1-3H3,(H2,17,18,19,20,21)