N-[4-(4-acetamido-2-fluoranyl-phenyl)-1,3-thiazol-2-yl]-1-(phenylcarbonyl)pyrrolidine-2-carboxamide

Systemtic Name: N-[4-(4-acetamido-2-fluoranyl-phenyl)-1,3-thiazol-2-yl]-1-(phenylcarbonyl)pyrrolidine-2-carboxamide Openeye Name: N-[4-(4-acetamido-2-fluoro-phenyl)thiazol-2-yl]-1-benzoyl-pyrrolidine-2-carboxamide CAS Name: N-[4-(4-acetamido-2-fluorophenyl)-2-thiazolyl]-1-benzoyl-2-pyrrolidinecarboxamide IUPAC Name: N-[4-(4-acetamido-2-fluorophenyl)-1,3-thiazol-2-yl]-1-benzoylpyrrolidine-2-carboxamide Traditional Name: N-[4-(4-acetamido-2-fluoro-phenyl)thiazol-2-yl]-1-benzoyl-pyrrolidine-2-carboxamide Formula: C23H21FN4O3S MolecularWeight: 452.501243

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=C(C=C1)C2=CSC(=N2)NC(=O)C3CCCN3C(=O)C4=CC=CC=C4)F

Isomeric SMILES

CC(=O)NC1=CC(=C(C=C1)C2=CSC(=N2)NC(=O)C3CCCN3C(=O)C4=CC=CC=C4)F

InChI

InChI=1S/C23H21FN4O3S/c1-14(29)25-16-9-10-17(18(24)12-16)19-13-32-23(26-19)27-21(30)20-8-5-11-28(20)22(31)15-6-3-2-4-7-15/h2-4,6-7,9-10,12-13,20H,5,8,11H2,1H3,(H,25,29)(H,26,27,30)