3-[1-(2,5-dimethylthiophen-3-yl)ethylamino]-4-fluoranyl-benzoic acid

Systemtic Name: 3-[1-(2,5-dimethylthiophen-3-yl)ethylamino]-4-fluoranyl-benzoic acid Openeye Name: 3-[1-(2,5-dimethyl-3-thienyl)ethylamino]-4-fluoro-benzoic acid CAS Name: 3-[1-(2,5-dimethyl-3-thiophenyl)ethylamino]-4-fluorobenzoic acid IUPAC Name: 3-[1-(2,5-dimethylthiophen-3-yl)ethylamino]-4-fluorobenzoic acid Traditional Name: 3-[1-(2,5-dimethyl-3-thienyl)ethylamino]-4-fluoro-benzoic acid Formula: C15H16FNO2S MolecularWeight: 293.356443

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)C)C(C)NC2=C(C=CC(=C2)C(=O)O)F

Isomeric SMILES

CC1=CC(=C(S1)C)C(C)NC2=C(C=CC(=C2)C(=O)O)F

InChI

InChI=1S/C15H16FNO2S/c1-8-6-12(10(3)20-8)9(2)17-14-7-11(15(18)19)4-5-13(14)16/h4-7,9,17H,1-3H3,(H,18,19)