methyl 3-[3-fluoranyl-2-[1-(methylamino)ethyl]phenyl]sulfanylpropanoate

Systemtic Name: methyl 3-[3-fluoranyl-2-[1-(methylamino)ethyl]phenyl]sulfanylpropanoate Openeye Name: methyl 3-[3-fluoro-2-[1-(methylamino)ethyl]phenyl]sulfanylpropanoate CAS Name: 3-[[3-fluoro-2-[1-(methylamino)ethyl]phenyl]thio]propanoic acid methyl ester IUPAC Name: methyl 3-[3-fluoro-2-[1-(methylamino)ethyl]phenyl]sulfanylpropanoate Traditional Name: 3-[[3-fluoro-2-[1-(methylamino)ethyl]phenyl]thio]propionic acid methyl ester Formula: C13H18FNO2S MolecularWeight: 271.350923

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(C=CC=C1SCCC(=O)OC)F)NC

Isomeric SMILES

CC(C1=C(C=CC=C1SCCC(=O)OC)F)NC

InChI

InChI=1S/C13H18FNO2S/c1-9(15-2)13-10(14)5-4-6-11(13)18-8-7-12(16)17-3/h4-6,9,15H,7-8H2,1-3H3