2-[[2-ethanoylsulfanylethyl-[2-(4-fluorophenyl)ethyl]carbamoyl]amino]propanoate

Systemtic Name: 2-[[2-ethanoylsulfanylethyl-[2-(4-fluorophenyl)ethyl]carbamoyl]amino]propanoate Openeye Name: 2-[[2-acetylsulfanylethyl-[2-(4-fluorophenyl)ethyl]carbamoyl]amino]propanoate CAS Name: 2-[[[2-(acetylthio)ethyl-[2-(4-fluorophenyl)ethyl]amino]-oxomethyl]amino]propanoate IUPAC Name: 2-[[2-acetylsulfanylethyl-[2-(4-fluorophenyl)ethyl]carbamoyl]amino]propanoate Traditional Name: 2-[[2-(acetylthio)ethyl-[2-(4-fluorophenyl)ethyl]carbamoyl]amino]propionate Formula: C16H20FN2O4S- MolecularWeight: 355.404403

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)[O-])NC(=O)N(CCC1=CC=C(C=C1)F)CCSC(=O)C

Isomeric SMILES

CC(C(=O)[O-])NC(=O)N(CCC1=CC=C(C=C1)F)CCSC(=O)C

InChI

InChI=1S/C16H21FN2O4S/c1-11(15(21)22)18-16(23)19(9-10-24-12(2)20)8-7-13-3-5-14(17)6-4-13/h3-6,11H,7-10H2,1-2H3,(H,18,23)(H,21,22)/p-1