tert-butyl 2-[2-fluoranyl-4-(pyrazin-2-ylcarbonylamino)phenyl]pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl 2-[2-fluoranyl-4-(pyrazin-2-ylcarbonylamino)phenyl]pyrrolidine-1-carboxylate Openeye Name: tert-butyl 2-[2-fluoro-4-(pyrazine-2-carbonylamino)phenyl]pyrrolidine-1-carboxylate CAS Name: 2-[2-fluoro-4-[[oxo(2-pyrazinyl)methyl]amino]phenyl]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-[2-fluoro-4-(pyrazine-2-carbonylamino)phenyl]pyrrolidine-1-carboxylate Traditional Name: 2-[2-fluoro-4-(pyrazinoylamino)phenyl]pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C20H23FN4O3 MolecularWeight: 386.420023

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCC1C2=C(C=C(C=C2)NC(=O)C3=NC=CN=C3)F

Isomeric SMILES

CC(C)(C)OC(=O)N1CCCC1C2=C(C=C(C=C2)NC(=O)C3=NC=CN=C3)F

InChI

InChI=1S/C20H23FN4O3/c1-20(2,3)28-19(27)25-10-4-5-17(25)14-7-6-13(11-15(14)21)24-18(26)16-12-22-8-9-23-16/h6-9,11-12,17H,4-5,10H2,1-3H3,(H,24,26)