2-[[2-ethanoylsulfanylethyl(3-phenylpropyl)carbamoyl]amino]propanoate

Systemtic Name: 2-[[2-ethanoylsulfanylethyl(3-phenylpropyl)carbamoyl]amino]propanoate Openeye Name: 2-[[2-acetylsulfanylethyl(3-phenylpropyl)carbamoyl]amino]propanoate CAS Name: 2-[[[2-(acetylthio)ethyl-(3-phenylpropyl)amino]-oxomethyl]amino]propanoate IUPAC Name: 2-[[2-acetylsulfanylethyl(3-phenylpropyl)carbamoyl]amino]propanoate Traditional Name: 2-[[2-(acetylthio)ethyl-(3-phenylpropyl)carbamoyl]amino]propionate Formula: C17H23N2O4S- MolecularWeight: 351.44052

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)[O-])NC(=O)N(CCCC1=CC=CC=C1)CCSC(=O)C

Isomeric SMILES

CC(C(=O)[O-])NC(=O)N(CCCC1=CC=CC=C1)CCSC(=O)C

InChI

InChI=1S/C17H24N2O4S/c1-13(16(21)22)18-17(23)19(11-12-24-14(2)20)10-6-9-15-7-4-3-5-8-15/h3-5,7-8,13H,6,9-12H2,1-2H3,(H,18,23)(H,21,22)/p-1