2-[(2-azanyl-4-methylsulfanyl-butanoyl)-phenylmethoxycarbonyl-amino]propanoic acid

Systemtic Name: 2-[(2-azanyl-4-methylsulfanyl-butanoyl)-phenylmethoxycarbonyl-amino]propanoic acid Openeye Name: 2-[(2-amino-4-methylsulfanyl-butanoyl)-benzyloxycarbonyl-amino]propanoic acid CAS Name: 2-[[2-amino-4-(methylthio)-1-oxobutyl]-phenylmethoxycarbonylamino]propanoic acid IUPAC Name: 2-[(2-amino-4-methylsulfanylbutanoyl)-phenylmethoxycarbonylamino]propanoic acid Traditional Name: 2-[[2-amino-4-(methylthio)butanoyl]-carbobenzoxy-amino]propionic acid Formula: C16H22N2O5S MolecularWeight: 354.42128

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H22N2O5S/c1-11(15(20)21)18(14(19)13(17)8-9-24-2)16(22)23-10-12-6-4-3-5-7-12/h3-7,11,13H,8-10,17H2,1-2H3,(H,20,21)