2-[(2-azanyl-4-fluoranyl-phenyl)sulfanylmethyl]-5-oxidanyl-pyran-4-one

Systemtic Name: 2-[(2-azanyl-4-fluoranyl-phenyl)sulfanylmethyl]-5-oxidanyl-pyran-4-one Openeye Name: 2-[(2-amino-4-fluoro-phenyl)sulfanylmethyl]-5-hydroxy-pyran-4-one CAS Name: 2-[[(2-amino-4-fluorophenyl)thio]methyl]-5-hydroxy-4-pyranone IUPAC Name: 2-[(2-amino-4-fluorophenyl)sulfanylmethyl]-5-hydroxypyran-4-one Traditional Name: 2-[[(2-amino-4-fluoro-phenyl)thio]methyl]-5-hydroxy-pyran-4-one Formula: C12H10FNO3S MolecularWeight: 267.276103

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1F)N)SCC2=CC(=O)C(=CO2)O

Isomeric SMILES

C1=CC(=C(C=C1F)N)SCC2=CC(=O)C(=CO2)O

InChI

InChI=1S/C12H10FNO3S/c13-7-1-2-12(9(14)3-7)18-6-8-4-10(15)11(16)5-17-8/h1-5,16H,6,14H2