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6-azanyl-2-[3-[3-(trifluoromethyl)phenoxy]propylsulfanyl]-1H-pyrimidin-4-one

6-azanyl-2-[3-[3-(trifluoromethyl)phenoxy]propylsulfanyl]-1H-pyrimidin-4-one

Systemtic Name:6-azanyl-2-[3-[3-(trifluoromethyl)phenoxy]propylsulfanyl]-1H-pyrimidin-4-one
Openeye Name:6-amino-2-[3-[3-(trifluoromethyl)phenoxy]propylsulfanyl]-1H-pyrimidin-4-one
CAS Name:6-amino-2-[3-[3-(trifluoromethyl)phenoxy]propylthio]-1H-pyrimidin-4-one
IUPAC Name:6-amino-2-[3-[3-(trifluoromethyl)phenoxy]propylsulfanyl]-1H-pyrimidin-4-one
Traditional Name:6-amino-2-[3-[3-(trifluoromethyl)phenoxy]propylthio]-1H-pyrimidin-4-one
Formula: C14H14F3N3O2S
MolecularWeight: 345.34007
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OCCCSC2=NC(=O)C=C(N2)N)C(F)(F)F


Isomeric SMILES

C1=CC(=CC(=C1)OCCCSC2=NC(=O)C=C(N2)N)C(F)(F)F


InChI

InChI=1S/C14H14F3N3O2S/c15-14(16,17)9-3-1-4-10(7-9)22-5-2-6-23-13-19-11(18)8-12(21)20-13/h1,3-4,7-8H,2,5-6H2,(H3,18,19,20,21)


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