methyl 3-azanyl-6-fluoranyl-2-sulfanyl-benzoate

Systemtic Name: methyl 3-azanyl-6-fluoranyl-2-sulfanyl-benzoate Openeye Name: methyl 3-amino-6-fluoro-2-sulfanyl-benzoate CAS Name: 3-amino-6-fluoro-2-mercaptobenzoic acid methyl ester IUPAC Name: methyl 3-amino-6-fluoro-2-sulfanylbenzoate Traditional Name: 3-amino-6-fluoro-2-mercapto-benzoic acid methyl ester Formula: C8H8FNO2S MolecularWeight: 201.218023

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CC(=C1S)N)F

Isomeric SMILES

COC(=O)C1=C(C=CC(=C1S)N)F

InChI

InChI=1S/C8H8FNO2S/c1-12-8(11)6-4(9)2-3-5(10)7(6)13/h2-3,13H,10H2,1H3