2-[[2,5-bis(chloranyl)phenyl]carbonylcarbamothioylamino]-5-bromanyl-benzoic acid

Systemtic Name: 2-[[2,5-bis(chloranyl)phenyl]carbonylcarbamothioylamino]-5-bromanyl-benzoic acid Openeye Name: 5-bromo-2-[(2,5-dichlorobenzoyl)carbamothioylamino]benzoic acid CAS Name: 5-bromo-2-[[[[(2,5-dichlorophenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]benzoic acid IUPAC Name: 5-bromo-2-[(2,5-dichlorobenzoyl)carbamothioylamino]benzoic acid Traditional Name: 5-bromo-2-[(2,5-dichlorobenzoyl)thiocarbamoylamino]benzoic acid Formula: C15H9BrCl2N2O3S MolecularWeight: 448.11856

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Cl)C(=O)NC(=S)NC2=C(C=C(C=C2)Br)C(=O)O)Cl

Isomeric SMILES

C1=CC(=C(C=C1Cl)C(=O)NC(=S)NC2=C(C=C(C=C2)Br)C(=O)O)Cl

InChI

InChI=1S/C15H9BrCl2N2O3S/c16-7-1-4-12(10(5-7)14(22)23)19-15(24)20-13(21)9-6-8(17)2-3-11(9)18/h1-6H,(H,22,23)(H2,19,20,21,24)