(2S)-N-[(2S)-2-Amino-3-[3-(1H-Imidazol-2-Ylmethyl)Imidazol-4-Yl]Propanoyl]-5-Oxo-N-[(2S)-1-Pentylpyrrolidine-2-Carbonyl]Pyrrolidine-2-Carboxamide
[CAS# 107810-09-3]

Identification

• Name: (2S)-N-[(2S)-2-Amino-3-[3-(1H-Imidazol-2-Ylmethyl)Imidazol-4-Yl]Propanoyl]-5-Oxo-N-[(2S)-1-Pentylpyrrolidine-2-Carbonyl]Pyrrolidine-2-Carboxamide
• Synonyms: (2S)-N-[(2S)-2-Amino-3-[3-(1H-Imidazol-2-Ylmethyl)-4-Imidazolyl]-1-Oxopropyl]-5-Oxo-N-[Oxo-[(2S)-1-Pentyl-2-Pyrrolidinyl]Methyl]-2-Pyrrolidinecarboxamide; (2S)-N-[(2S)-2-Amino-3-[3-(1H-Imidazol-2-Ylmethyl)Imidazol-4-Yl]Propanoyl]-N-[(2S)-1-Amylpyrrolidine-2-Carbonyl]-5-Keto-Pyrrolidine-2-Carboxamide; (2S)-N-[(2S)-2-Amino-3-[3-(1H-Imidazol-2-Ylmethyl)Imidazol-4-Yl]Propanoyl]-5-Oxo-N-[(2S)-1-Pentylpyrrolidin-2-Yl]Carbonyl-Pyrrolidine-2-Carboxamide
• Molecular Formula: C₂₅H₃₆N₈O₄
• Molecular Weight: 512.61
• CAS Registry Number: 107810-09-3
• SMILES: [C@H]4(C(=O)N(C([C@@H](N)CC1=CN=C[N]1CC2=NC=C[NH]2)=O)C([C@H]3NC(CC3)=O)=O)N(CCC4)CCCCC
• InChI: 1S/C25H36N8O4/c1-2-3-4-11-31-12-5-6-20(31)25(37)33(24(36)19-7-8-22(34)30-19)23(35)18(26)13-17-14-27-16-32(17)15-21-28-9-10-29-21/h9-10,14,16,18-20H,2-8,11-13,15,26H2,1H3,(H,28,29)(H,30,34)/t18-,19-,20-/m0/s1
• InChIKey: RESILIOYOJMCAR-UFYCRDLUSA-N

Properties

• Density: 1.437g/cm³ (Cal.)