ethyl 3-benzamido-2-[[2-[(2-ethanoylsulfanyl-3-methyl-butanoyl)amino]-2-methyl-propanoyl]amino]propanoate

Systemtic Name: ethyl 3-benzamido-2-[[2-[(2-ethanoylsulfanyl-3-methyl-butanoyl)amino]-2-methyl-propanoyl]amino]propanoate Openeye Name: ethyl 2-[[2-[(2-acetylsulfanyl-3-methyl-butanoyl)amino]-2-methyl-propanoyl]amino]-3-benzamido-propanoate CAS Name: 2-[[2-[[2-(acetylthio)-3-methyl-1-oxobutyl]amino]-2-methyl-1-oxopropyl]amino]-3-benzamidopropanoic acid ethyl ester IUPAC Name: ethyl 2-[[2-[(2-acetylsulfanyl-3-methylbutanoyl)amino]-2-methylpropanoyl]amino]-3-benzamidopropanoate Traditional Name: 2-[[2-[[2-(acetylthio)-3-methyl-butanoyl]amino]-2-methyl-propanoyl]amino]-3-benzamido-propionic acid ethyl ester Formula: C23H33N3O6S MolecularWeight: 479.58962

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CNC(=O)C1=CC=CC=C1)NC(=O)C(C)(C)NC(=O)C(C(C)C)SC(=O)C

Isomeric SMILES

CCOC(=O)C(CNC(=O)C1=CC=CC=C1)NC(=O)C(C)(C)NC(=O)C(C(C)C)SC(=O)C

InChI

InChI=1S/C23H33N3O6S/c1-7-32-21(30)17(13-24-19(28)16-11-9-8-10-12-16)25-22(31)23(5,6)26-20(29)18(14(2)3)33-15(4)27/h8-12,14,17-18H,7,13H2,1-6H3,(H,24,28)(H,25,31)(H,26,29)