Tert-Butyl N-[(2S)-1-[[(3S)-1-(1-Amino-1-Oxo-3-Phenylpropan-2-Yl)-2,5-Dioxopyrrolidin-3-Yl]Amino]-4-Methyl-1-Oxopentan-2-Yl]Carbamate
[CAS# 114646-30-9]

Identification

• Name: Tert-Butyl N-[(2S)-1-[[(3S)-1-(1-Amino-1-Oxo-3-Phenylpropan-2-Yl)-2,5-Dioxopyrrolidin-3-Yl]Amino]-4-Methyl-1-Oxopentan-2-Yl]Carbamate
• Synonyms: Tert-Butyl N-[(1S)-1-[[(3S)-1-[2-Amino-2-Oxo-1-(Phenylmethyl)Ethyl]-2,5-Dioxo-Pyrrolidin-3-Yl]Carbamoyl]-3-Methyl-Butyl]Carbamate; N-[(1S)-1-[[[(3S)-1-[2-Amino-2-Oxo-1-(Phenylmethyl)Ethyl]-2,5-Dioxo-3-Pyrrolidinyl]Amino]-Oxomethyl]-3-Methylbutyl]Carbamic Acid Tert-Butyl Ester; N-[(1S)-1-[[(3S)-1-[2-Amino-1-(Benzyl)-2-Keto-Ethyl]-2,5-Diketo-Pyrrolidin-3-Yl]Carbamoyl]-3-Methyl-Butyl]Carbamic Acid Tert-Butyl Ester
• Molecular Formula: C₂₄H₃₄N₄O₆
• Molecular Weight: 474.56
• CAS Registry Number: 114646-30-9
• SMILES: [C@H](NC(=O)OC(C)(C)C)(CC(C)C)C(=O)N[C@@H]1C(N(C(C1)=O)C(C(=O)N)CC2=CC=CC=C2)=O
• InChI: 1S/C24H34N4O6/c1-14(2)11-16(27-23(33)34-24(3,4)5)21(31)26-17-13-19(29)28(22(17)32)18(20(25)30)12-15-9-7-6-8-10-15/h6-10,14,16-18H,11-13H2,1-5H3,(H2,25,30)(H,26,31)(H,27,33)/t16-,17-,18?/m0/s1
• InChIKey: RCOSIAQBXIYIDW-UBFHEZILSA-N

Properties

• Density: 1.238g/cm³ (Cal.)
• Boiling point: 775.065°C at 760 mmHg (Cal.)
• Flash point: 422.544°C (Cal.)