(2S)-N-[(2R)-2-Amino-3-Phenylpropanoyl]-1-[(1S)-1-Cyano-4-(Diaminomethylideneamino)Butyl]Pyrrolidine-2-Carboxamide
[CAS# 111009-86-0]

Identification

• Name: (2S)-N-[(2R)-2-Amino-3-Phenylpropanoyl]-1-[(1S)-1-Cyano-4-(Diaminomethylideneamino)Butyl]Pyrrolidine-2-Carboxamide
• Synonyms: (2S)-N-[(2R)-2-Amino-3-Phenyl-Propanoyl]-1-[(1S)-1-Cyano-4-Guanidino-Butyl]Pyrrolidine-2-Carboxamide; (2S)-N-[(2R)-2-Amino-1-Oxo-3-Phenylpropyl]-1-[(1S)-1-Cyano-4-Guanidinobutyl]-2-Pyrrolidinecarboxamide; (2S)-N-[(2R)-2-Amino-3-Phenyl-Propanoyl]-1-[(1S)-1-Cyano-4-(Diaminomethylideneamino)Butyl]Pyrrolidine-2-Carboxamide
• Molecular Formula: C₂₀H₂₉N₇O₂
• Molecular Weight: 399.49
• CAS Registry Number: 111009-86-0
• SMILES: [C@@H]1(N(CCC1)[C@@H](CCCN=C(N)N)C#N)C(=O)NC(=O)[C@H](N)CC2=CC=CC=C2
• InChI: 1S/C20H29N7O2/c21-13-15(8-4-10-25-20(23)24)27-11-5-9-17(27)19(29)26-18(28)16(22)12-14-6-2-1-3-7-14/h1-3,6-7,15-17H,4-5,8-12,22H2,(H4,23,24,25)(H,26,28,29)/t15-,16+,17-/m0/s1
• InChIKey: KIJDUGBFUBCRNM-BBWFWOEESA-N