2-[(4-Tert-Butylbenzoyl)Amino]-4-(Methylthio)Butanoic Acid
[CAS# 65054-82-2]

Identification

• Name: 2-[(4-Tert-Butylbenzoyl)Amino]-4-(Methylthio)Butanoic Acid
• Synonyms: (2S)-2-[(4-Tert-Butylbenzoyl)Amino]-4-Methylsulfanyl-Butanoate; (2S)-2-[[(4-Tert-Butylphenyl)-Oxomethyl]Amino]-4-(Methylthio)Butanoate; (2S)-2-[(4-Tert-Butylbenzoyl)Amino]-4-(Methylthio)Butyrate
• Molecular Formula: C₁₆H₂₂NO₃S
• Molecular Weight: 308.41
• CAS Registry Number: 65054-82-2
• SMILES: [C@@H](NC(=O)C1=CC=C(C(C)(C)C)C=C1)(C([O-])=O)CCSC
• InChI: 1S/C16H23NO3S/c1-16(2,3)12-7-5-11(6-8-12)14(18)17-13(15(19)20)9-10-21-4/h5-8,13H,9-10H2,1-4H3,(H,17,18)(H,19,20)/p-1/t13-/m0/s1
• InChIKey: OMVWMIUSYMYXOJ-ZDUSSCGKSA-M