2-(2-fluorophenyl)-2-[[2-(phenylmethyl)-3-sulfanyl-propanoyl]amino]ethanoic acid

Systemtic Name: 2-(2-fluorophenyl)-2-[[2-(phenylmethyl)-3-sulfanyl-propanoyl]amino]ethanoic acid Openeye Name: 2-[(2-benzyl-3-sulfanyl-propanoyl)amino]-2-(2-fluorophenyl)acetic acid CAS Name: 2-(2-fluorophenyl)-2-[[2-(mercaptomethyl)-1-oxo-3-phenylpropyl]amino]acetic acid IUPAC Name: 2-[(2-benzyl-3-sulfanylpropanoyl)amino]-2-(2-fluorophenyl)acetic acid Traditional Name: 2-[(2-benzyl-3-mercapto-propanoyl)amino]-2-(2-fluorophenyl)acetic acid Formula: C18H18FNO3S MolecularWeight: 347.403823

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(CS)C(=O)NC(C2=CC=CC=C2F)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CC(CS)C(=O)NC(C2=CC=CC=C2F)C(=O)O

InChI

InChI=1S/C18H18FNO3S/c19-15-9-5-4-8-14(15)16(18(22)23)20-17(21)13(11-24)10-12-6-2-1-3-7-12/h1-9,13,16,24H,10-11H2,(H,20,21)(H,22,23)