2-[[2-methyl-2-(phenylmethoxycarbonylamino)propanoyl]amino]-4-methylsulfanyl-butanoic acid

Systemtic Name: 2-[[2-methyl-2-(phenylmethoxycarbonylamino)propanoyl]amino]-4-methylsulfanyl-butanoic acid Openeye Name: 2-[[2-(benzyloxycarbonylamino)-2-methyl-propanoyl]amino]-4-methylsulfanyl-butanoic acid CAS Name: 2-[[2-methyl-1-oxo-2-(phenylmethoxycarbonylamino)propyl]amino]-4-(methylthio)butanoic acid IUPAC Name: 2-[[2-methyl-2-(phenylmethoxycarbonylamino)propanoyl]amino]-4-methylsulfanylbutanoic acid Traditional Name: 2-[[2-(benzyloxycarbonylamino)-2-methyl-propanoyl]amino]-4-(methylthio)butyric acid Formula: C17H24N2O5S MolecularWeight: 368.44786

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)NC(CCSC)C(=O)O)NC(=O)OCC1=CC=CC=C1

Isomeric SMILES

CC(C)(C(=O)NC(CCSC)C(=O)O)NC(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C17H24N2O5S/c1-17(2,15(22)18-13(14(20)21)9-10-25-3)19-16(23)24-11-12-7-5-4-6-8-12/h4-8,13H,9-11H2,1-3H3,(H,18,22)(H,19,23)(H,20,21)