ethyl (2S)-2-azanyl-3-[(4-methoxyphenyl)methylsulfanyl]-3-methyl-butanoate

Systemtic Name: ethyl (2S)-2-azanyl-3-[(4-methoxyphenyl)methylsulfanyl]-3-methyl-butanoate Openeye Name: ethyl (2S)-2-amino-3-[(4-methoxyphenyl)methylsulfanyl]-3-methyl-butanoate CAS Name: (2S)-2-amino-3-[(4-methoxyphenyl)methylthio]-3-methylbutanoic acid ethyl ester IUPAC Name: ethyl (2S)-2-amino-3-[(4-methoxyphenyl)methylsulfanyl]-3-methylbutanoate Traditional Name: (2S)-2-amino-3-methyl-3-(p-anisylthio)butyric acid ethyl ester Formula: C15H23NO3S MolecularWeight: 297.41302

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(C)(C)SCC1=CC=C(C=C1)OC)N

Isomeric SMILES

CCOC(=O)[C@@H](C(C)(C)SCC1=CC=C(C=C1)OC)N

InChI

InChI=1S/C15H23NO3S/c1-5-19-14(17)13(16)15(2,3)20-10-11-6-8-12(18-4)9-7-11/h6-9,13H,5,10,16H2,1-4H3/t13-/m0/s1