5-bromanyl-2-(carbamothioylamino)benzoate

Systemtic Name: 5-bromanyl-2-(carbamothioylamino)benzoate Openeye Name: 5-bromo-2-(carbamothioylamino)benzoate CAS Name: 5-bromo-2-(carbamothioylamino)benzoate IUPAC Name: 5-bromo-2-(carbamothioylamino)benzoate Traditional Name: 5-bromo-2-thioureido-benzoate Formula: C8H6BrN2O2S- MolecularWeight: 274.11444

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Br)C(=O)[O-])NC(=S)N

Isomeric SMILES

C1=CC(=C(C=C1Br)C(=O)[O-])NC(=S)N

InChI

InChI=1S/C8H7BrN2O2S/c9-4-1-2-6(11-8(10)14)5(3-4)7(12)13/h1-3H,(H,12,13)(H3,10,11,14)/p-1