methyl 2-[3-(4-fluorophenyl)sulfanylpropanoylamino]ethanoate

Systemtic Name: methyl 2-[3-(4-fluorophenyl)sulfanylpropanoylamino]ethanoate Openeye Name: methyl 2-[3-(4-fluorophenyl)sulfanylpropanoylamino]acetate CAS Name: 2-[[3-[(4-fluorophenyl)thio]-1-oxopropyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[3-(4-fluorophenyl)sulfanylpropanoylamino]acetate Traditional Name: 2-[3-[(4-fluorophenyl)thio]propanoylamino]acetic acid methyl ester Formula: C12H14FNO3S MolecularWeight: 271.307863

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CNC(=O)CCSC1=CC=C(C=C1)F

Isomeric SMILES

COC(=O)CNC(=O)CCSC1=CC=C(C=C1)F

InChI

InChI=1S/C12H14FNO3S/c1-17-12(16)8-14-11(15)6-7-18-10-4-2-9(13)3-5-10/h2-5H,6-8H2,1H3,(H,14,15)