2-[[2-(3,5-ditert-butyl-4-oxidanyl-phenyl)ethyl-(2-ethanoylsulfanylethyl)carbamoyl]amino]propanoic acid

Systemtic Name: 2-[[2-(3,5-ditert-butyl-4-oxidanyl-phenyl)ethyl-(2-ethanoylsulfanylethyl)carbamoyl]amino]propanoic acid Openeye Name: 2-[[2-acetylsulfanylethyl-[2-(3,5-ditert-butyl-4-hydroxy-phenyl)ethyl]carbamoyl]amino]propanoic acid CAS Name: 2-[[[2-(acetylthio)ethyl-[2-(3,5-ditert-butyl-4-hydroxyphenyl)ethyl]amino]-oxomethyl]amino]propanoic acid IUPAC Name: 2-[[2-acetylsulfanylethyl-[2-(3,5-ditert-butyl-4-hydroxyphenyl)ethyl]carbamoyl]amino]propanoic acid Traditional Name: 2-[[2-(acetylthio)ethyl-[2-(3,5-ditert-butyl-4-hydroxy-phenyl)ethyl]carbamoyl]amino]propionic acid Formula: C24H38N2O5S MolecularWeight: 466.63392

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)NC(=O)N(CCC1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C)CCSC(=O)C

Isomeric SMILES

CC(C(=O)O)NC(=O)N(CCC1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C)CCSC(=O)C

InChI

InChI=1S/C24H38N2O5S/c1-15(21(29)30)25-22(31)26(11-12-32-16(2)27)10-9-17-13-18(23(3,4)5)20(28)19(14-17)24(6,7)8/h13-15,28H,9-12H2,1-8H3,(H,25,31)(H,29,30)