N-[1-[[1-bis(oxidanidyl)boranyl-3-methyl-butyl]amino]-1-oxidanylidene-3-phenyl-propan-2-yl]pyrazine-2-carboxamide

Systemtic Name: N-[1-[[1-bis(oxidanidyl)boranyl-3-methyl-butyl]amino]-1-oxidanylidene-3-phenyl-propan-2-yl]pyrazine-2-carboxamide Openeye Name: N-[1-benzyl-2-[(1-dioxidoboranyl-3-methyl-butyl)amino]-2-oxo-ethyl]pyrazine-2-carboxamide CAS Name: N-[1-[(1-dioxidoboranyl-3-methylbutyl)amino]-1-oxo-3-phenylpropan-2-yl]-2-pyrazinecarboxamide IUPAC Name: N-[1-[(1-dioxidoboranyl-3-methylbutyl)amino]-1-oxo-3-phenylpropan-2-yl]pyrazine-2-carboxamide Traditional Name: N-[1-benzyl-2-[(1-dioxidoboranyl-3-methyl-butyl)amino]-2-keto-ethyl]pyrazinamide Formula: C19H23BN4O4-2 MolecularWeight: 382.22132

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

B(C(CC(C)C)NC(=O)C(CC1=CC=CC=C1)NC(=O)C2=NC=CN=C2)([O-])[O-]

Isomeric SMILES

B(C(CC(C)C)NC(=O)C(CC1=CC=CC=C1)NC(=O)C2=NC=CN=C2)([O-])[O-]

InChI

InChI=1S/C19H23BN4O4/c1-13(2)10-17(20(27)28)24-18(25)15(11-14-6-4-3-5-7-14)23-19(26)16-12-21-8-9-22-16/h3-9,12-13,15,17H,10-11H2,1-2H3,(H,23,26)(H,24,25)/q-2