1-(4-bromanyl-1-methyl-pyrazol-3-yl)sulfonyl-3-(4,6-dimethoxypyrimidin-2-yl)urea

Systemtic Name: 1-(4-bromanyl-1-methyl-pyrazol-3-yl)sulfonyl-3-(4,6-dimethoxypyrimidin-2-yl)urea Openeye Name: 1-(4-bromo-1-methyl-pyrazol-3-yl)sulfonyl-3-(4,6-dimethoxypyrimidin-2-yl)urea CAS Name: 1-[(4-bromo-1-methyl-3-pyrazolyl)sulfonyl]-3-(4,6-dimethoxy-2-pyrimidinyl)urea IUPAC Name: 1-(4-bromo-1-methylpyrazol-3-yl)sulfonyl-3-(4,6-dimethoxypyrimidin-2-yl)urea Traditional Name: 1-(4-bromo-1-methyl-pyrazol-3-yl)sulfonyl-3-(4,6-dimethoxypyrimidin-2-yl)urea Formula: C11H13BrN6O5S MolecularWeight: 421.22712

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=N1)S(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC)Br

Isomeric SMILES

CN1C=C(C(=N1)S(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC)Br

InChI

InChI=1S/C11H13BrN6O5S/c1-18-5-6(12)9(16-18)24(20,21)17-11(19)15-10-13-7(22-2)4-8(14-10)23-3/h4-5H,1-3H3,(H2,13,14,15,17,19)