2-(2-ethanoylsulfanylethyl)-3-(phenethylcarbamoylamino)pentanoic acid

Systemtic Name: 2-(2-ethanoylsulfanylethyl)-3-(phenethylcarbamoylamino)pentanoic acid Openeye Name: 2-(2-acetylsulfanylethyl)-3-(phenethylcarbamoylamino)pentanoic acid CAS Name: 2-[2-(acetylthio)ethyl]-3-[[oxo-(phenethylamino)methyl]amino]pentanoic acid IUPAC Name: 2-(2-acetylsulfanylethyl)-3-(phenethylcarbamoylamino)pentanoic acid Traditional Name: 2-[2-(acetylthio)ethyl]-3-(phenethylcarbamoylamino)valeric acid Formula: C18H26N2O4S MolecularWeight: 366.47504

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(CCSC(=O)C)C(=O)O)NC(=O)NCCC1=CC=CC=C1

Isomeric SMILES

CCC(C(CCSC(=O)C)C(=O)O)NC(=O)NCCC1=CC=CC=C1

InChI

InChI=1S/C18H26N2O4S/c1-3-16(15(17(22)23)10-12-25-13(2)21)20-18(24)19-11-9-14-7-5-4-6-8-14/h4-8,15-16H,3,9-12H2,1-2H3,(H,22,23)(H2,19,20,24)