2-azanyl-2-[3-fluoranyl-5-(4-methylsulfanylphenyl)carbonyl-phenyl]ethanoic acid

Systemtic Name: 2-azanyl-2-[3-fluoranyl-5-(4-methylsulfanylphenyl)carbonyl-phenyl]ethanoic acid Openeye Name: 2-amino-2-[3-fluoro-5-(4-methylsulfanylbenzoyl)phenyl]acetic acid CAS Name: 2-amino-2-[3-fluoro-5-[[4-(methylthio)phenyl]-oxomethyl]phenyl]acetic acid IUPAC Name: 2-amino-2-[3-fluoro-5-(4-methylsulfanylbenzoyl)phenyl]acetic acid Traditional Name: 2-amino-2-[3-fluoro-5-[4-(methylthio)benzoyl]phenyl]acetic acid Formula: C16H14FNO3S MolecularWeight: 319.350663

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C(=O)C2=CC(=CC(=C2)F)C(C(=O)O)N

Isomeric SMILES

CSC1=CC=C(C=C1)C(=O)C2=CC(=CC(=C2)F)C(C(=O)O)N

InChI

InChI=1S/C16H14FNO3S/c1-22-13-4-2-9(3-5-13)15(19)11-6-10(7-12(17)8-11)14(18)16(20)21/h2-8,14H,18H2,1H3,(H,20,21)