2-[4-[(4-fluorophenyl)methylcarbamothioylamino]phenyl]ethanoic acid

Systemtic Name: 2-[4-[(4-fluorophenyl)methylcarbamothioylamino]phenyl]ethanoic acid Openeye Name: 2-[4-[(4-fluorophenyl)methylcarbamothioylamino]phenyl]acetic acid CAS Name: 2-[4-[[[(4-fluorophenyl)methylamino]-sulfanylidenemethyl]amino]phenyl]acetic acid IUPAC Name: 2-[4-[(4-fluorophenyl)methylcarbamothioylamino]phenyl]acetic acid Traditional Name: 2-[4-[(4-fluorobenzyl)thiocarbamoylamino]phenyl]acetic acid Formula: C16H15FN2O2S MolecularWeight: 318.365903

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC(=O)O)NC(=S)NCC2=CC=C(C=C2)F

Isomeric SMILES

C1=CC(=CC=C1CC(=O)O)NC(=S)NCC2=CC=C(C=C2)F

InChI

InChI=1S/C16H15FN2O2S/c17-13-5-1-12(2-6-13)10-18-16(22)19-14-7-3-11(4-8-14)9-15(20)21/h1-8H,9-10H2,(H,20,21)(H2,18,19,22)