tert-butyl 4-[[5-[3-fluoranyl-4-(propylcarbamoyl)phenyl]pyrimidin-2-yl]oxymethyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[[5-[3-fluoranyl-4-(propylcarbamoyl)phenyl]pyrimidin-2-yl]oxymethyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[[5-[3-fluoro-4-(propylcarbamoyl)phenyl]pyrimidin-2-yl]oxymethyl]piperidine-1-carboxylate CAS Name: 4-[[5-[3-fluoro-4-[oxo(propylamino)methyl]phenyl]-2-pyrimidinyl]oxymethyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[[5-[3-fluoro-4-(propylcarbamoyl)phenyl]pyrimidin-2-yl]oxymethyl]piperidine-1-carboxylate Traditional Name: 4-[[5-[3-fluoro-4-(propylcarbamoyl)phenyl]pyrimidin-2-yl]oxymethyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C25H33FN4O4 MolecularWeight: 472.552323

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1=C(C=C(C=C1)C2=CN=C(N=C2)OCC3CCN(CC3)C(=O)OC(C)(C)C)F

Isomeric SMILES

CCCNC(=O)C1=C(C=C(C=C1)C2=CN=C(N=C2)OCC3CCN(CC3)C(=O)OC(C)(C)C)F

InChI

InChI=1S/C25H33FN4O4/c1-5-10-27-22(31)20-7-6-18(13-21(20)26)19-14-28-23(29-15-19)33-16-17-8-11-30(12-9-17)24(32)34-25(2,3)4/h6-7,13-15,17H,5,8-12,16H2,1-4H3,(H,27,31)