(4-bromanyl-2,6-dimethyl-phenyl) 1,3-dimethyl-2,4-bis(oxidanylidene)pyrimidine-5-sulfonate

Systemtic Name: (4-bromanyl-2,6-dimethyl-phenyl) 1,3-dimethyl-2,4-bis(oxidanylidene)pyrimidine-5-sulfonate Openeye Name: (4-bromo-2,6-dimethyl-phenyl) 1,3-dimethyl-2,4-dioxo-pyrimidine-5-sulfonate CAS Name: 1,3-dimethyl-2,4-dioxo-5-pyrimidinesulfonic acid (4-bromo-2,6-dimethylphenyl) ester IUPAC Name: (4-bromo-2,6-dimethylphenyl) 1,3-dimethyl-2,4-dioxopyrimidine-5-sulfonate Traditional Name: 2,4-diketo-1,3-dimethyl-pyrimidine-5-sulfonic acid (4-bromo-2,6-dimethyl-phenyl) ester Formula: C14H15BrN2O5S MolecularWeight: 403.2483

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OS(=O)(=O)C2=CN(C(=O)N(C2=O)C)C)C)Br

Isomeric SMILES

CC1=CC(=CC(=C1OS(=O)(=O)C2=CN(C(=O)N(C2=O)C)C)C)Br

InChI

InChI=1S/C14H15BrN2O5S/c1-8-5-10(15)6-9(2)12(8)22-23(20,21)11-7-16(3)14(19)17(4)13(11)18/h5-7H,1-4H3