3-(3-bromophenyl)-4-oxidanylidene-2-sulfanylidene-1H-pyrimidine-5-carboxylic acid

Systemtic Name: 3-(3-bromophenyl)-4-oxidanylidene-2-sulfanylidene-1H-pyrimidine-5-carboxylic acid Openeye Name: 3-(3-bromophenyl)-4-oxo-2-thioxo-1H-pyrimidine-5-carboxylic acid CAS Name: 3-(3-bromophenyl)-4-oxo-2-sulfanylidene-1H-pyrimidine-5-carboxylic acid IUPAC Name: 3-(3-bromophenyl)-4-oxo-2-sulfanylidene-1H-pyrimidine-5-carboxylic acid Traditional Name: 3-(3-bromophenyl)-4-keto-2-thioxo-1H-pyrimidine-5-carboxylic acid Formula: C11H7BrN2O3S MolecularWeight: 327.15388

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)N2C(=O)C(=CNC2=S)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)Br)N2C(=O)C(=CNC2=S)C(=O)O

InChI

InChI=1S/C11H7BrN2O3S/c12-6-2-1-3-7(4-6)14-9(15)8(10(16)17)5-13-11(14)18/h1-5H,(H,13,18)(H,16,17)