4,4,4-tris(fluoranyl)-1-[3-(1-pyrimidin-2-ylpiperidin-4-yl)pyrrolidin-1-yl]butan-1-one

Systemtic Name: 4,4,4-tris(fluoranyl)-1-[3-(1-pyrimidin-2-ylpiperidin-4-yl)pyrrolidin-1-yl]butan-1-one Openeye Name: 4,4,4-trifluoro-1-[3-(1-pyrimidin-2-yl-4-piperidyl)pyrrolidin-1-yl]butan-1-one CAS Name: 4,4,4-trifluoro-1-[3-[1-(2-pyrimidinyl)-4-piperidinyl]-1-pyrrolidinyl]-1-butanone IUPAC Name: 4,4,4-trifluoro-1-[3-(1-pyrimidin-2-ylpiperidin-4-yl)pyrrolidin-1-yl]butan-1-one Traditional Name: 4,4,4-trifluoro-1-[3-[1-(2-pyrimidyl)-4-piperidyl]pyrrolidino]butan-1-one Formula: C17H23F3N4O MolecularWeight: 356.38593

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2CCN(C2)C(=O)CCC(F)(F)F)C3=NC=CC=N3

Isomeric SMILES

C1CN(CCC1C2CCN(C2)C(=O)CCC(F)(F)F)C3=NC=CC=N3

InChI

InChI=1S/C17H23F3N4O/c18-17(19,20)6-2-15(25)24-11-5-14(12-24)13-3-9-23(10-4-13)16-21-7-1-8-22-16/h1,7-8,13-14H,2-6,9-12H2