6-[(1S)-1-[2,6-bis(fluoranyl)phenyl]ethyl]-2-cyclopentylsulfanyl-1H-pyrimidin-4-one

Systemtic Name: 6-[(1S)-1-[2,6-bis(fluoranyl)phenyl]ethyl]-2-cyclopentylsulfanyl-1H-pyrimidin-4-one Openeye Name: 2-cyclopentylsulfanyl-6-[(1S)-1-(2,6-difluorophenyl)ethyl]-1H-pyrimidin-4-one CAS Name: 2-(cyclopentylthio)-6-[(1S)-1-(2,6-difluorophenyl)ethyl]-1H-pyrimidin-4-one IUPAC Name: 2-cyclopentylsulfanyl-6-[(1S)-1-(2,6-difluorophenyl)ethyl]-1H-pyrimidin-4-one Traditional Name: 2-(cyclopentylthio)-6-[(1S)-1-(2,6-difluorophenyl)ethyl]-1H-pyrimidin-4-one Formula: C17H18F2N2OS MolecularWeight: 336.399426

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=O)N=C(N1)SC2CCCC2)C3=C(C=CC=C3F)F

Isomeric SMILES

C[C@H](C1=CC(=O)N=C(N1)SC2CCCC2)C3=C(C=CC=C3F)F

InChI

InChI=1S/C17H18F2N2OS/c1-10(16-12(18)7-4-8-13(16)19)14-9-15(22)21-17(20-14)23-11-5-2-3-6-11/h4,7-11H,2-3,5-6H2,1H3,(H,20,21,22)/t10-/m1/s1