2-[2-methyl-3-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]propyl]sulfanyl-1H-pyrimidin-6-one

Systemtic Name: 2-[2-methyl-3-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]propyl]sulfanyl-1H-pyrimidin-6-one Openeye Name: 2-[2-methyl-3-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]propyl]sulfanyl-1H-pyrimidin-6-one CAS Name: 2-[[2-methyl-3-[4-[3-(trifluoromethyl)phenyl]-1-piperazinyl]propyl]thio]-1H-pyrimidin-6-one IUPAC Name: 2-[2-methyl-3-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]propyl]sulfanyl-1H-pyrimidin-6-one Traditional Name: 2-[[2-methyl-3-[4-[3-(trifluoromethyl)phenyl]piperazino]propyl]thio]-1H-pyrimidin-6-one Formula: C19H23F3N4OS MolecularWeight: 412.47233

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN1CCN(CC1)C2=CC=CC(=C2)C(F)(F)F)CSC3=NC=CC(=O)N3

Isomeric SMILES

CC(CN1CCN(CC1)C2=CC=CC(=C2)C(F)(F)F)CSC3=NC=CC(=O)N3

InChI

InChI=1S/C19H23F3N4OS/c1-14(13-28-18-23-6-5-17(27)24-18)12-25-7-9-26(10-8-25)16-4-2-3-15(11-16)19(20,21)22/h2-6,11,14H,7-10,12-13H2,1H3,(H,23,24,27)