methyl (2S)-2-[3-(4-fluorophenyl)sulfanylpropanoylamino]-3-(4-hydroxyphenyl)propanoate

Systemtic Name: methyl (2S)-2-[3-(4-fluorophenyl)sulfanylpropanoylamino]-3-(4-hydroxyphenyl)propanoate Openeye Name: methyl (2S)-2-[3-(4-fluorophenyl)sulfanylpropanoylamino]-3-(4-hydroxyphenyl)propanoate CAS Name: (2S)-2-[[3-[(4-fluorophenyl)thio]-1-oxopropyl]amino]-3-(4-hydroxyphenyl)propanoic acid methyl ester IUPAC Name: methyl (2S)-2-[3-(4-fluorophenyl)sulfanylpropanoylamino]-3-(4-hydroxyphenyl)propanoate Traditional Name: (2S)-2-[3-[(4-fluorophenyl)thio]propanoylamino]-3-(4-hydroxyphenyl)propionic acid methyl ester Formula: C19H20FNO4S MolecularWeight: 377.429803

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=C(C=C1)O)NC(=O)CCSC2=CC=C(C=C2)F

Isomeric SMILES

COC(=O)[C@H](CC1=CC=C(C=C1)O)NC(=O)CCSC2=CC=C(C=C2)F

InChI

InChI=1S/C19H20FNO4S/c1-25-19(24)17(12-13-2-6-15(22)7-3-13)21-18(23)10-11-26-16-8-4-14(20)5-9-16/h2-9,17,22H,10-12H2,1H3,(H,21,23)/t17-/m0/s1