1-[4-(4-fluorophenyl)piperidin-1-yl]sulfonyl-5-pyrimidin-2-yl-pentan-2-one

Systemtic Name: 1-[4-(4-fluorophenyl)piperidin-1-yl]sulfonyl-5-pyrimidin-2-yl-pentan-2-one Openeye Name: 1-[[4-(4-fluorophenyl)-1-piperidyl]sulfonyl]-5-pyrimidin-2-yl-pentan-2-one CAS Name: 1-[[4-(4-fluorophenyl)-1-piperidinyl]sulfonyl]-5-(2-pyrimidinyl)-2-pentanone IUPAC Name: 1-[4-(4-fluorophenyl)piperidin-1-yl]sulfonyl-5-pyrimidin-2-ylpentan-2-one Traditional Name: 1-[4-(4-fluorophenyl)piperidino]sulfonyl-5-(2-pyrimidyl)pentan-2-one Formula: C20H24FN3O3S MolecularWeight: 405.486263

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=CC=C(C=C2)F)S(=O)(=O)CC(=O)CCCC3=NC=CC=N3

Isomeric SMILES

C1CN(CCC1C2=CC=C(C=C2)F)S(=O)(=O)CC(=O)CCCC3=NC=CC=N3

InChI

InChI=1S/C20H24FN3O3S/c21-18-7-5-16(6-8-18)17-9-13-24(14-10-17)28(26,27)15-19(25)3-1-4-20-22-11-2-12-23-20/h2,5-8,11-12,17H,1,3-4,9-10,13-15H2