ethyl 2-azanyl-3-[1-(4-propan-2-ylphenyl)ethylsulfanyl]propanoate

Systemtic Name: ethyl 2-azanyl-3-[1-(4-propan-2-ylphenyl)ethylsulfanyl]propanoate Openeye Name: ethyl 2-amino-3-[1-(4-isopropylphenyl)ethylsulfanyl]propanoate CAS Name: 2-amino-3-[1-(4-propan-2-ylphenyl)ethylthio]propanoic acid ethyl ester IUPAC Name: ethyl 2-amino-3-[1-(4-propan-2-ylphenyl)ethylsulfanyl]propanoate Traditional Name: 2-amino-3-(1-p-cumenylethylthio)propionic acid ethyl ester Formula: C16H25NO2S MolecularWeight: 295.4402

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CSC(C)C1=CC=C(C=C1)C(C)C)N

Isomeric SMILES

CCOC(=O)C(CSC(C)C1=CC=C(C=C1)C(C)C)N

InChI

InChI=1S/C16H25NO2S/c1-5-19-16(18)15(17)10-20-12(4)14-8-6-13(7-9-14)11(2)3/h6-9,11-12,15H,5,10,17H2,1-4H3