2-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-olate

Systemtic Name: 2-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-olate Openeye Name: 2-[(2-chloro-6-fluoro-phenyl)methylsulfanyl]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-olate CAS Name: 2-[(2-chloro-6-fluorophenyl)methylthio]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-olate IUPAC Name: 2-[(2-chloro-6-fluorophenyl)methylsulfanyl]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-olate Traditional Name: 2-[(2-chloro-6-fluoro-benzyl)thio]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-olate Formula: C14H11ClFN2OS- MolecularWeight: 309.766343

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)N=C(N=C2[O-])SCC3=C(C=CC=C3Cl)F

Isomeric SMILES

C1CC2=C(C1)N=C(N=C2[O-])SCC3=C(C=CC=C3Cl)F

InChI

InChI=1S/C14H12ClFN2OS/c15-10-4-2-5-11(16)9(10)7-20-14-17-12-6-1-3-8(12)13(19)18-14/h2,4-5H,1,3,6-7H2,(H,17,18,19)/p-1