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

Systemtic Name: 1-(4,6-dimethoxypyrimidin-2-yl)-3-(2-methylsulfonyl-6-phenyl-phenyl)sulfonyl-urea Openeye Name: 1-(4,6-dimethoxypyrimidin-2-yl)-3-(2-methylsulfonyl-6-phenyl-phenyl)sulfonyl-urea CAS Name: 1-(4,6-dimethoxy-2-pyrimidinyl)-3-(2-methylsulfonyl-6-phenylphenyl)sulfonylurea IUPAC Name: 1-(4,6-dimethoxypyrimidin-2-yl)-3-(2-methylsulfonyl-6-phenylphenyl)sulfonylurea Traditional Name: 1-(4,6-dimethoxypyrimidin-2-yl)-3-(2-mesyl-6-phenyl-phenyl)sulfonyl-urea Formula: C20H20N4O7S2 MolecularWeight: 492.5254

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=NC(=N1)NC(=O)NS(=O)(=O)C2=C(C=CC=C2S(=O)(=O)C)C3=CC=CC=C3)OC

Isomeric SMILES

COC1=CC(=NC(=N1)NC(=O)NS(=O)(=O)C2=C(C=CC=C2S(=O)(=O)C)C3=CC=CC=C3)OC

InChI

InChI=1S/C20H20N4O7S2/c1-30-16-12-17(31-2)22-19(21-16)23-20(25)24-33(28,29)18-14(13-8-5-4-6-9-13)10-7-11-15(18)32(3,26)27/h4-12H,1-3H3,(H2,21,22,23,24,25)