2-fluoranyl-5-[(4-methylsulfanylphenyl)methylamino]benzoic acid

Systemtic Name: 2-fluoranyl-5-[(4-methylsulfanylphenyl)methylamino]benzoic acid Openeye Name: 2-fluoro-5-[(4-methylsulfanylphenyl)methylamino]benzoic acid CAS Name: 2-fluoro-5-[[4-(methylthio)phenyl]methylamino]benzoic acid IUPAC Name: 2-fluoro-5-[(4-methylsulfanylphenyl)methylamino]benzoic acid Traditional Name: 2-fluoro-5-[[4-(methylthio)benzyl]amino]benzoic acid Formula: C15H14FNO2S MolecularWeight: 291.340563

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)CNC2=CC(=C(C=C2)F)C(=O)O

Isomeric SMILES

CSC1=CC=C(C=C1)CNC2=CC(=C(C=C2)F)C(=O)O

InChI

InChI=1S/C15H14FNO2S/c1-20-12-5-2-10(3-6-12)9-17-11-4-7-14(16)13(8-11)15(18)19/h2-8,17H,9H2,1H3,(H,18,19)