1-[2-[3,3,3-tris(fluoranyl)propylsulfanyl]pyrimidin-4-yl]oxycyclopent-2-en-1-amine

Systemtic Name: 1-[2-[3,3,3-tris(fluoranyl)propylsulfanyl]pyrimidin-4-yl]oxycyclopent-2-en-1-amine Openeye Name: 1-[2-(3,3,3-trifluoropropylsulfanyl)pyrimidin-4-yl]oxycyclopent-2-en-1-amine CAS Name: 1-[[2-(3,3,3-trifluoropropylthio)-4-pyrimidinyl]oxy]-1-cyclopent-2-enamine IUPAC Name: 1-[2-(3,3,3-trifluoropropylsulfanyl)pyrimidin-4-yl]oxycyclopent-2-en-1-amine Traditional Name: [1-[2-(3,3,3-trifluoropropylthio)pyrimidin-4-yl]oxycyclopent-2-en-1-yl]amine Formula: C12H14F3N3OS MolecularWeight: 305.31927

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C=C1)(N)OC2=NC(=NC=C2)SCCC(F)(F)F

Isomeric SMILES

C1CC(C=C1)(N)OC2=NC(=NC=C2)SCCC(F)(F)F

InChI

InChI=1S/C12H14F3N3OS/c13-12(14,15)6-8-20-10-17-7-3-9(18-10)19-11(16)4-1-2-5-11/h1,3-4,7H,2,5-6,8,16H2