4-fluoranyl-N'-(2-pyrimidin-2-ylsulfanylethanoyl)benzohydrazide

Systemtic Name: 4-fluoranyl-N'-(2-pyrimidin-2-ylsulfanylethanoyl)benzohydrazide Openeye Name: 4-fluoro-N'-(2-pyrimidin-2-ylsulfanylacetyl)benzohydrazide CAS Name: 4-fluoro-N'-[1-oxo-2-(2-pyrimidinylthio)ethyl]benzohydrazide IUPAC Name: 4-fluoro-N'-(2-pyrimidin-2-ylsulfanylacetyl)benzohydrazide Traditional Name: 4-fluoro-N'-[2-(2-pyrimidylthio)acetyl]benzohydrazide Formula: C13H11FN4O2S MolecularWeight: 306.315443

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(N=C1)SCC(=O)NNC(=O)C2=CC=C(C=C2)F

Isomeric SMILES

C1=CN=C(N=C1)SCC(=O)NNC(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C13H11FN4O2S/c14-10-4-2-9(3-5-10)12(20)18-17-11(19)8-21-13-15-6-1-7-16-13/h1-7H,8H2,(H,17,19)(H,18,20)