2-[[(4-fluorophenyl)methyl-(phenylmethyl)carbamothioyl]amino]ethanoate

Systemtic Name: 2-[[(4-fluorophenyl)methyl-(phenylmethyl)carbamothioyl]amino]ethanoate Openeye Name: 2-[[benzyl-[(4-fluorophenyl)methyl]carbamothioyl]amino]acetate CAS Name: 2-[[[(4-fluorophenyl)methyl-(phenylmethyl)amino]-sulfanylidenemethyl]amino]acetate IUPAC Name: 2-[[benzyl-[(4-fluorophenyl)methyl]carbamothioyl]amino]acetate Traditional Name: 2-[[benzyl-(4-fluorobenzyl)thiocarbamoyl]amino]acetate Formula: C17H16FN2O2S- MolecularWeight: 331.384543

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(CC2=CC=C(C=C2)F)C(=S)NCC(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CN(CC2=CC=C(C=C2)F)C(=S)NCC(=O)[O-]

InChI

InChI=1S/C17H17FN2O2S/c18-15-8-6-14(7-9-15)12-20(17(23)19-10-16(21)22)11-13-4-2-1-3-5-13/h1-9H,10-12H2,(H,19,23)(H,21,22)/p-1