2-[(6-azanylpyridin-3-yl)sulfanylmethyl]-5-oxidanyl-pyran-4-one

Systemtic Name: 2-[(6-azanylpyridin-3-yl)sulfanylmethyl]-5-oxidanyl-pyran-4-one Openeye Name: 2-[(6-amino-3-pyridyl)sulfanylmethyl]-5-hydroxy-pyran-4-one CAS Name: 2-[[(6-amino-3-pyridinyl)thio]methyl]-5-hydroxy-4-pyranone IUPAC Name: 2-[(6-aminopyridin-3-yl)sulfanylmethyl]-5-hydroxypyran-4-one Traditional Name: 2-[[(6-amino-3-pyridyl)thio]methyl]-5-hydroxy-pyran-4-one Formula: C11H10N2O3S MolecularWeight: 250.2737

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=NC=C1SCC2=CC(=O)C(=CO2)O)N

Isomeric SMILES

C1=CC(=NC=C1SCC2=CC(=O)C(=CO2)O)N

InChI

InChI=1S/C11H10N2O3S/c12-11-2-1-8(4-13-11)17-6-7-3-9(14)10(15)5-16-7/h1-5,15H,6H2,(H2,12,13)