4-[(2-bromophenyl)carbonylcarbamothioylamino]-2-chloranyl-benzoic acid

Systemtic Name: 4-[(2-bromophenyl)carbonylcarbamothioylamino]-2-chloranyl-benzoic acid Openeye Name: 4-[(2-bromobenzoyl)carbamothioylamino]-2-chloro-benzoic acid CAS Name: 4-[[[[(2-bromophenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]-2-chlorobenzoic acid IUPAC Name: 4-[(2-bromobenzoyl)carbamothioylamino]-2-chlorobenzoic acid Traditional Name: 4-[(2-bromobenzoyl)thiocarbamoylamino]-2-chloro-benzoic acid Formula: C15H10BrClN2O3S MolecularWeight: 413.6735

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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