3-[(2-bromophenyl)carbonylcarbamothioylamino]-4-chloranyl-benzoate

Systemtic Name: 3-[(2-bromophenyl)carbonylcarbamothioylamino]-4-chloranyl-benzoate Openeye Name: 3-[(2-bromobenzoyl)carbamothioylamino]-4-chloro-benzoate CAS Name: 3-[[[[(2-bromophenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]-4-chlorobenzoate IUPAC Name: 3-[(2-bromobenzoyl)carbamothioylamino]-4-chlorobenzoate Traditional Name: 3-[(2-bromobenzoyl)thiocarbamoylamino]-4-chloro-benzoate Formula: C15H9BrClN2O3S- MolecularWeight: 412.66556

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NC(=S)NC2=C(C=CC(=C2)C(=O)[O-])Cl)Br

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NC(=S)NC2=C(C=CC(=C2)C(=O)[O-])Cl)Br

InChI

InChI=1S/C15H10BrClN2O3S/c16-10-4-2-1-3-9(10)13(20)19-15(23)18-12-7-8(14(21)22)5-6-11(12)17/h1-7H,(H,21,22)(H2,18,19,20,23)/p-1