2-[5-fluoranyl-2-[1-[(4-methylsulfanylphenyl)amino]ethyl]indol-5-yl]ethanoic acid

Systemtic Name: 2-[5-fluoranyl-2-[1-[(4-methylsulfanylphenyl)amino]ethyl]indol-5-yl]ethanoic acid Openeye Name: 2-[5-fluoro-2-[1-(4-methylsulfanylanilino)ethyl]indol-5-yl]acetic acid CAS Name: 2-[5-fluoro-2-[1-[4-(methylthio)anilino]ethyl]-5-indolyl]acetic acid IUPAC Name: 2-[5-fluoro-2-[1-(4-methylsulfanylanilino)ethyl]indol-5-yl]acetic acid Traditional Name: 2-[5-fluoro-2-[1-[4-(methylthio)anilino]ethyl]indol-5-yl]acetic acid Formula: C19H19FN2O2S MolecularWeight: 358.429763

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=CC(C=CC2=N1)(CC(=O)O)F)NC3=CC=C(C=C3)SC

Isomeric SMILES

CC(C1=CC2=CC(C=CC2=N1)(CC(=O)O)F)NC3=CC=C(C=C3)SC

InChI

InChI=1S/C19H19FN2O2S/c1-12(21-14-3-5-15(25-2)6-4-14)17-9-13-10-19(20,11-18(23)24)8-7-16(13)22-17/h3-10,12,21H,11H2,1-2H3,(H,23,24)