4-Azidobenzoyltrimethionine
[CAS# 85119-89-7]

Identification

• Name: 4-Azidobenzoyltrimethionine
• Synonyms: (2S)-2-[[(2S)-2-[[(2S)-2-[(4-Azidobenzoyl)Amino]-4-Methylsulfanyl-Butanoyl]Amino]-4-Methylsulfanyl-Butanoyl]Amino]-4-Methylsulfanyl-Butanoic Acid; (2S)-2-[[(2S)-2-[[(2S)-2-[[(4-Azidophenyl)-Oxomethyl]Amino]-4-(Methylthio)-1-Oxobutyl]Amino]-4-(Methylthio)-1-Oxobutyl]Amino]-4-(Methylthio)Butanoic Acid; (2S)-2-[[(2S)-2-[[(2S)-2-[(4-Azidobenzoyl)Amino]-4-(Methylthio)Butanoyl]Amino]-4-(Methylthio)Butanoyl]Amino]-4-(Methylthio)Butyric Acid
• Molecular Formula: C₂₂H₃₂N₆O₅S₃
• Molecular Weight: 556.71
• CAS Registry Number: 85119-89-7
• SMILES: [C@H](C(=O)O)(NC([C@@H](NC([C@@H](NC(C1=CC=C(C=C1)N=[N+]=[N-])=O)CCSC)=O)CCSC)=O)CCSC
• InChI: 1S/C22H32N6O5S3/c1-34-11-8-16(24-19(29)14-4-6-15(7-5-14)27-28-23)20(30)25-17(9-12-35-2)21(31)26-18(22(32)33)10-13-36-3/h4-7,16-18H,8-13H2,1-3H3,(H,24,29)(H,25,30)(H,26,31)(H,32,33)/t16-,17-,18-/m0/s1
• InChIKey: PRIWCYCKMFZMMN-BZSNNMDCSA-N