N-[(2-ethylsulfanyl-5-fluoranyl-4-oxidanylidene-1H-pyrimidin-6-yl)methylideneamino]benzenesulfonamide

Systemtic Name: N-[(2-ethylsulfanyl-5-fluoranyl-4-oxidanylidene-1H-pyrimidin-6-yl)methylideneamino]benzenesulfonamide Openeye Name: N-[(2-ethylsulfanyl-5-fluoro-4-oxo-1H-pyrimidin-6-yl)methyleneamino]benzenesulfonamide CAS Name: N-[[2-(ethylthio)-5-fluoro-4-oxo-1H-pyrimidin-6-yl]methylideneamino]benzenesulfonamide IUPAC Name: N-[(2-ethylsulfanyl-5-fluoro-4-oxo-1H-pyrimidin-6-yl)methylideneamino]benzenesulfonamide Traditional Name: N-[[2-(ethylthio)-5-fluoro-4-keto-1H-pyrimidin-6-yl]methyleneamino]benzenesulfonamide Formula: C13H13FN4O3S2 MolecularWeight: 356.395723

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NC(=O)C(=C(N1)C=NNS(=O)(=O)C2=CC=CC=C2)F

Isomeric SMILES

CCSC1=NC(=O)C(=C(N1)C=NNS(=O)(=O)C2=CC=CC=C2)F

InChI

InChI=1S/C13H13FN4O3S2/c1-2-22-13-16-10(11(14)12(19)17-13)8-15-18-23(20,21)9-6-4-3-5-7-9/h3-8,18H,2H2,1H3,(H,16,17,19)