(2S)-2-[2-(4-fluorophenyl)ethylcarbamoylamino]-4-methylsulfanyl-butanoate

Systemtic Name: (2S)-2-[2-(4-fluorophenyl)ethylcarbamoylamino]-4-methylsulfanyl-butanoate Openeye Name: (2S)-2-[2-(4-fluorophenyl)ethylcarbamoylamino]-4-methylsulfanyl-butanoate CAS Name: (2S)-2-[[[2-(4-fluorophenyl)ethylamino]-oxomethyl]amino]-4-(methylthio)butanoate IUPAC Name: (2S)-2-[2-(4-fluorophenyl)ethylcarbamoylamino]-4-methylsulfanylbutanoate Traditional Name: (2S)-2-[2-(4-fluorophenyl)ethylcarbamoylamino]-4-(methylthio)butyrate Formula: C14H18FN2O3S- MolecularWeight: 313.367723

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)[O-])NC(=O)NCCC1=CC=C(C=C1)F

Isomeric SMILES

CSCC[C@@H](C(=O)[O-])NC(=O)NCCC1=CC=C(C=C1)F

InChI

InChI=1S/C14H19FN2O3S/c1-21-9-7-12(13(18)19)17-14(20)16-8-6-10-2-4-11(15)5-3-10/h2-5,12H,6-9H2,1H3,(H,18,19)(H2,16,17,20)/p-1/t12-/m0/s1