2,6-bis(azanyl)-2-[2-azanyl-3-(1H-imidazol-5-yl)propanoyl]-3-pyrrolidin-2-ylcarbonyl-hexanoic acid

Systemtic Name: 2,6-bis(azanyl)-2-[2-azanyl-3-(1H-imidazol-5-yl)propanoyl]-3-pyrrolidin-2-ylcarbonyl-hexanoic acid Openeye Name: 2,6-diamino-2-[2-amino-3-(1H-imidazol-5-yl)propanoyl]-3-(pyrrolidine-2-carbonyl)hexanoic acid CAS Name: 2,6-diamino-2-[2-amino-3-(1H-imidazol-5-yl)-1-oxopropyl]-3-[oxo(2-pyrrolidinyl)methyl]hexanoic acid IUPAC Name: 2,6-diamino-2-[2-amino-3-(1H-imidazol-5-yl)propanoyl]-3-(pyrrolidine-2-carbonyl)hexanoic acid Traditional Name: 2,6-diamino-2-[2-amino-3-(1H-imidazol-5-yl)propanoyl]-3-prolyl-hexanoic acid Formula: C17H28N6O4 MolecularWeight: 380.44202

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(NC1)C(=O)C(CCCN)C(C(=O)C(CC2=CN=CN2)N)(C(=O)O)N

Isomeric SMILES

C1CC(NC1)C(=O)C(CCCN)C(C(=O)C(CC2=CN=CN2)N)(C(=O)O)N

InChI

InChI=1S/C17H28N6O4/c18-5-1-3-11(14(24)13-4-2-6-22-13)17(20,16(26)27)15(25)12(19)7-10-8-21-9-23-10/h8-9,11-13,22H,1-7,18-20H2,(H,21,23)(H,26,27)