(3aS,4S,6aR)-Hexahydro-2-Oxo-1H-Thieno[3,4-d]Imidazole-4-Pentanoic Acid 4-NitroPhenyl Ester,
[CAS# 95114-52-6]

Identification

• Name: (3aS,4S,6aR)-Hexahydro-2-Oxo-1H-Thieno[3,4-d]Imidazole-4-Pentanoic Acid 4-NitroPhenyl Ester,
• Synonyms: 5-[(3Ar,6S,6As)-2-Oxo-1,3,3A,4,6,6A-Hexahydrothieno[3,4-D]Imidazol-6-Yl]Pentanoic Acid (4-Nitrophenyl) Ester; 5-[(3Ar,6S,6As)-2-Keto-1,3,3A,4,6,6A-Hexahydrothieno[3,4-D]Imidazol-6-Yl]Valeric Acid (4-Nitrophenyl) Ester; 1H-Thieno(3,4-D)Imidazole-4-Pentanoic
• Molecular Formula: C₁₆H₁₉N₃O₅S
• Molecular Weight: 365.40
• CAS Registry Number: 95114-52-6
• SMILES: [C@H]12NC(=O)N[C@H]1CS[C@H]2CCCCC(OC3=CC=C([N+]([O-])=O)C=C3)=O
• InChI: 1S/C16H19N3O5S/c20-14(24-11-7-5-10(6-8-11)19(22)23)4-2-1-3-13-15-12(9-25-13)17-16(21)18-15/h5-8,12-13,15H,1-4,9H2,(H2,17,18,21)/t12-,13-,15-/m0/s1
• InChIKey: YUDNXDTXQPYKCA-YDHLFZDLSA-N