2-[4-[(3-chloranyl-4-fluoranyl-phenyl)carbamothioylamino]phenyl]ethanoic acid

Systemtic Name: 2-[4-[(3-chloranyl-4-fluoranyl-phenyl)carbamothioylamino]phenyl]ethanoic acid Openeye Name: 2-[4-[(3-chloro-4-fluoro-phenyl)carbamothioylamino]phenyl]acetic acid CAS Name: 2-[4-[[(3-chloro-4-fluoroanilino)-sulfanylidenemethyl]amino]phenyl]acetic acid IUPAC Name: 2-[4-[(3-chloro-4-fluorophenyl)carbamothioylamino]phenyl]acetic acid Traditional Name: 2-[4-[(3-chloro-4-fluoro-phenyl)thiocarbamoylamino]phenyl]acetic acid Formula: C15H12ClFN2O2S MolecularWeight: 338.784383

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC(=O)O)NC(=S)NC2=CC(=C(C=C2)F)Cl

Isomeric SMILES

C1=CC(=CC=C1CC(=O)O)NC(=S)NC2=CC(=C(C=C2)F)Cl

InChI

InChI=1S/C15H12ClFN2O2S/c16-12-8-11(5-6-13(12)17)19-15(22)18-10-3-1-9(2-4-10)7-14(20)21/h1-6,8H,7H2,(H,20,21)(H2,18,19,22)