2-(4-azanyl-2-fluoranyl-phenyl)sulfanyl-6-methyl-pyrimidin-4-olate

Systemtic Name: 2-(4-azanyl-2-fluoranyl-phenyl)sulfanyl-6-methyl-pyrimidin-4-olate Openeye Name: 2-(4-amino-2-fluoro-phenyl)sulfanyl-6-methyl-pyrimidin-4-olate CAS Name: 2-[(4-amino-2-fluorophenyl)thio]-6-methyl-4-pyrimidinolate IUPAC Name: 2-(4-amino-2-fluorophenyl)sulfanyl-6-methylpyrimidin-4-olate Traditional Name: 2-[(4-amino-2-fluoro-phenyl)thio]-6-methyl-pyrimidin-4-olate Formula: C11H9FN3OS- MolecularWeight: 250.272063

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SC2=C(C=C(C=C2)N)F)[O-]

Isomeric SMILES

CC1=CC(=NC(=N1)SC2=C(C=C(C=C2)N)F)[O-]

InChI

InChI=1S/C11H10FN3OS/c1-6-4-10(16)15-11(14-6)17-9-3-2-7(13)5-8(9)12/h2-5H,13H2,1H3,(H,14,15,16)/p-1