methyl 5-[1-(3-bromanylthiophen-2-yl)ethylamino]-2-fluoranyl-benzoate

Systemtic Name: methyl 5-[1-(3-bromanylthiophen-2-yl)ethylamino]-2-fluoranyl-benzoate Openeye Name: methyl 5-[1-(3-bromo-2-thienyl)ethylamino]-2-fluoro-benzoate CAS Name: 5-[1-(3-bromo-2-thiophenyl)ethylamino]-2-fluorobenzoic acid methyl ester IUPAC Name: methyl 5-[1-(3-bromothiophen-2-yl)ethylamino]-2-fluorobenzoate Traditional Name: 5-[1-(3-bromo-2-thienyl)ethylamino]-2-fluoro-benzoic acid methyl ester Formula: C14H13BrFNO2S MolecularWeight: 358.225923

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(C=CS1)Br)NC2=CC(=C(C=C2)F)C(=O)OC

Isomeric SMILES

CC(C1=C(C=CS1)Br)NC2=CC(=C(C=C2)F)C(=O)OC

InChI

InChI=1S/C14H13BrFNO2S/c1-8(13-11(15)5-6-20-13)17-9-3-4-12(16)10(7-9)14(18)19-2/h3-8,17H,1-2H3