[(1R)-1-[[(2S)-2-azanyl-3-phenyl-propanoyl]-pyrazin-2-ylcarbonyl-amino]-3-methyl-butyl]boronic acid

Systemtic Name: [(1R)-1-[[(2S)-2-azanyl-3-phenyl-propanoyl]-pyrazin-2-ylcarbonyl-amino]-3-methyl-butyl]boronic acid Openeye Name: [(1R)-1-[[(2S)-2-amino-3-phenyl-propanoyl]-(pyrazine-2-carbonyl)amino]-3-methyl-butyl]boronic acid CAS Name: [(1R)-1-[[(2S)-2-amino-1-oxo-3-phenylpropyl]-[oxo(2-pyrazinyl)methyl]amino]-3-methylbutyl]boronic acid IUPAC Name: [(1R)-1-[[(2S)-2-amino-3-phenylpropanoyl]-(pyrazine-2-carbonyl)amino]-3-methylbutyl]boronic acid Traditional Name: [(1R)-1-[[(2S)-2-amino-3-phenyl-propanoyl]-pyrazinoyl-amino]-3-methyl-butyl]boronic acid Formula: C19H25BN4O4 MolecularWeight: 384.2372

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Descriptors Computed from Structure

Canonical SMILES:

B(C(CC(C)C)N(C(=O)C1=NC=CN=C1)C(=O)C(CC2=CC=CC=C2)N)(O)O

Isomeric SMILES

B([C@H](CC(C)C)N(C(=O)C1=NC=CN=C1)C(=O)[C@H](CC2=CC=CC=C2)N)(O)O

InChI

InChI=1S/C19H25BN4O4/c1-13(2)10-17(20(27)28)24(19(26)16-12-22-8-9-23-16)18(25)15(21)11-14-6-4-3-5-7-14/h3-9,12-13,15,17,27-28H,10-11,21H2,1-2H3/t15-,17-/m0/s1