methyl 5-[1-(3-bromanylthiophen-2-yl)ethylamino]-2,4-bis(fluoranyl)benzoate

Systemtic Name: methyl 5-[1-(3-bromanylthiophen-2-yl)ethylamino]-2,4-bis(fluoranyl)benzoate Openeye Name: methyl 5-[1-(3-bromo-2-thienyl)ethylamino]-2,4-difluoro-benzoate CAS Name: 5-[1-(3-bromo-2-thiophenyl)ethylamino]-2,4-difluorobenzoic acid methyl ester IUPAC Name: methyl 5-[1-(3-bromothiophen-2-yl)ethylamino]-2,4-difluorobenzoate Traditional Name: 5-[1-(3-bromo-2-thienyl)ethylamino]-2,4-difluoro-benzoic acid methyl ester Formula: C14H12BrF2NO2S MolecularWeight: 376.216386

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H12BrF2NO2S/c1-7(13-9(15)3-4-21-13)18-12-5-8(14(19)20-2)10(16)6-11(12)17/h3-7,18H,1-2H3