3-fluoranyl-N'-oxidanyl-4-(pyrimidin-2-ylsulfanylmethyl)benzenecarboximidamide

Systemtic Name: 3-fluoranyl-N'-oxidanyl-4-(pyrimidin-2-ylsulfanylmethyl)benzenecarboximidamide Openeye Name: 3-fluoro-N'-hydroxy-4-(pyrimidin-2-ylsulfanylmethyl)benzamidine CAS Name: 3-fluoro-N'-hydroxy-4-[(2-pyrimidinylthio)methyl]benzenecarboximidamide IUPAC Name: 3-fluoro-N'-hydroxy-4-(pyrimidin-2-ylsulfanylmethyl)benzenecarboximidamide Traditional Name: 3-fluoro-N'-hydroxy-4-[(2-pyrimidylthio)methyl]benzamidine Formula: C12H11FN4OS MolecularWeight: 278.305343

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(N=C1)SCC2=C(C=C(C=C2)C(=NO)N)F

Isomeric SMILES

C1=CN=C(N=C1)SCC2=C(C=C(C=C2)/C(=N/O)/N)F

InChI

InChI=1S/C12H11FN4OS/c13-10-6-8(11(14)17-18)2-3-9(10)7-19-12-15-4-1-5-16-12/h1-6,18H,7H2,(H2,14,17)