(4-fluorophenyl)methyl 2-[[2-(phenylmethyl)-3-sulfanyl-propanoyl]amino]ethanoate

Systemtic Name: (4-fluorophenyl)methyl 2-[[2-(phenylmethyl)-3-sulfanyl-propanoyl]amino]ethanoate Openeye Name: (4-fluorophenyl)methyl 2-[(2-benzyl-3-sulfanyl-propanoyl)amino]acetate CAS Name: 2-[[2-(mercaptomethyl)-1-oxo-3-phenylpropyl]amino]acetic acid (4-fluorophenyl)methyl ester IUPAC Name: (4-fluorophenyl)methyl 2-[(2-benzyl-3-sulfanylpropanoyl)amino]acetate Traditional Name: 2-[(2-benzyl-3-mercapto-propanoyl)amino]acetic acid (4-fluorobenzyl) ester Formula: C19H20FNO3S MolecularWeight: 361.430403

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(CS)C(=O)NCC(=O)OCC2=CC=C(C=C2)F

Isomeric SMILES

C1=CC=C(C=C1)CC(CS)C(=O)NCC(=O)OCC2=CC=C(C=C2)F

InChI

InChI=1S/C19H20FNO3S/c20-17-8-6-15(7-9-17)12-24-18(22)11-21-19(23)16(13-25)10-14-4-2-1-3-5-14/h1-9,16,25H,10-13H2,(H,21,23)