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

Systemtic Name: methyl 3-[3-fluoranyl-2-[1-(propylamino)ethyl]phenyl]sulfanylpropanoate Openeye Name: methyl 3-[3-fluoro-2-[1-(propylamino)ethyl]phenyl]sulfanylpropanoate CAS Name: 3-[[3-fluoro-2-[1-(propylamino)ethyl]phenyl]thio]propanoic acid methyl ester IUPAC Name: methyl 3-[3-fluoro-2-[1-(propylamino)ethyl]phenyl]sulfanylpropanoate Traditional Name: 3-[[3-fluoro-2-[1-(propylamino)ethyl]phenyl]thio]propionic acid methyl ester Formula: C15H22FNO2S MolecularWeight: 299.404083

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H22FNO2S/c1-4-9-17-11(2)15-12(16)6-5-7-13(15)20-10-8-14(18)19-3/h5-7,11,17H,4,8-10H2,1-3H3