ethyl 2-(2-azanyl-5-propanoyl-phenyl)-2-methylsulfanyl-propanoate

Systemtic Name: ethyl 2-(2-azanyl-5-propanoyl-phenyl)-2-methylsulfanyl-propanoate Openeye Name: ethyl 2-(2-amino-5-propanoyl-phenyl)-2-methylsulfanyl-propanoate CAS Name: 2-[2-amino-5-(1-oxopropyl)phenyl]-2-(methylthio)propanoic acid ethyl ester IUPAC Name: ethyl 2-(2-amino-5-propanoylphenyl)-2-methylsulfanylpropanoate Traditional Name: 2-(2-amino-5-propionyl-phenyl)-2-(methylthio)propionic acid ethyl ester Formula: C15H21NO3S MolecularWeight: 295.39714

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=CC(=C(C=C1)N)C(C)(C(=O)OCC)SC

Isomeric SMILES

CCC(=O)C1=CC(=C(C=C1)N)C(C)(C(=O)OCC)SC

InChI

InChI=1S/C15H21NO3S/c1-5-13(17)10-7-8-12(16)11(9-10)15(3,20-4)14(18)19-6-2/h7-9H,5-6,16H2,1-4H3