1-[2,4-bis(bromanyl)phenyl]-2,4-dimethyl-6-oxidanylidene-pyrimidine-5-sulfonic acid

Systemtic Name: 1-[2,4-bis(bromanyl)phenyl]-2,4-dimethyl-6-oxidanylidene-pyrimidine-5-sulfonic acid Openeye Name: 1-(2,4-dibromophenyl)-2,4-dimethyl-6-oxo-pyrimidine-5-sulfonic acid CAS Name: 1-(2,4-dibromophenyl)-2,4-dimethyl-6-oxo-5-pyrimidinesulfonic acid IUPAC Name: 1-(2,4-dibromophenyl)-2,4-dimethyl-6-oxopyrimidine-5-sulfonic acid Traditional Name: 1-(2,4-dibromophenyl)-6-keto-2,4-dimethyl-pyrimidine-5-sulfonic acid Formula: C12H10Br2N2O4S MolecularWeight: 438.0918

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(C(=N1)C)C2=C(C=C(C=C2)Br)Br)S(=O)(=O)O

Isomeric SMILES

CC1=C(C(=O)N(C(=N1)C)C2=C(C=C(C=C2)Br)Br)S(=O)(=O)O

InChI

InChI=1S/C12H10Br2N2O4S/c1-6-11(21(18,19)20)12(17)16(7(2)15-6)10-4-3-8(13)5-9(10)14/h3-5H,1-2H3,(H,18,19,20)