N-[(2S)-1-[[(2S)-1-Amino-1-Oxopropan-2-Yl]Amino]-1-Oxo-3-Phenylpropan-2-Yl]-N'-[(2R)-2-[[(2S)-2-Amino-3-(4-Sulfanylphenyl)Propanoyl]Amino]Propanoyl]Oxamide
[CAS# 143791-43-9]

Identification

• Name: N-[(2S)-1-[[(2S)-1-Amino-1-Oxopropan-2-Yl]Amino]-1-Oxo-3-Phenylpropan-2-Yl]-N'-[(2R)-2-[[(2S)-2-Amino-3-(4-Sulfanylphenyl)Propanoyl]Amino]Propanoyl]Oxamide
• Synonyms: N-[(1S)-2-[[(1S)-2-Amino-1-Methyl-2-Oxo-Ethyl]Amino]-2-Oxo-1-(Phenylmethyl)Ethyl]-N'-[(2R)-2-[[(2S)-2-Amino-3-(4-Sulfanylphenyl)Propanoyl]Amino]Propanoyl]Oxamide; N'-[(2R)-2-[[(2S)-2-Amino-3-(4-Mercaptophenyl)-1-Oxopropyl]Amino]-1-Oxopropyl]-N-[(1S)-2-[[(1S)-2-Amino-1-Methyl-2-Oxoethyl]Amino]-2-Oxo-1-(Phenylmethyl)Ethyl]Oxamide; N-[(1S)-2-[[(1S)-2-Amino-2-Keto-1-Methyl-Ethyl]Amino]-1-(Benzyl)-2-Keto-Ethyl]-N'-[(2R)-2-[[(2S)-2-Amino-3-(4-Mercaptophenyl)Propanoyl]Amino]Propanoyl]Oxamide
• Molecular Formula: C₂₆H₃₂N₆O₆S
• Molecular Weight: 556.64
• CAS Registry Number: 143791-43-9
• SMILES: [C@H](C(=O)N)(NC([C@@H](NC(C(NC([C@H](NC([C@@H](N)CC1=CC=C(S)C=C1)=O)C)=O)=O)=O)CC2=CC=CC=C2)=O)C
• InChI: 1S/C26H32N6O6S/c1-14(21(28)33)29-24(36)20(13-16-6-4-3-5-7-16)31-25(37)26(38)32-22(34)15(2)30-23(35)19(27)12-17-8-10-18(39)11-9-17/h3-11,14-15,19-20,39H,12-13,27H2,1-2H3,(H2,28,33)(H,29,36)(H,30,35)(H,31,37)(H,32,34,38)/t14-,15+,19-,20-/m0/s1
• InChIKey: MUHVZDABSVKTIA-VZJWBNGJSA-N

Properties

• Density: 1.324g/cm³ (Cal.)