2-[(4-aminophenyl)sulfanylmethyl]-5-oxidanyl-pyran-4-one

Systemtic Name: 2-[(4-aminophenyl)sulfanylmethyl]-5-oxidanyl-pyran-4-one Openeye Name: 2-[(4-aminophenyl)sulfanylmethyl]-5-hydroxy-pyran-4-one CAS Name: 2-[[(4-aminophenyl)thio]methyl]-5-hydroxy-4-pyranone IUPAC Name: 2-[(4-aminophenyl)sulfanylmethyl]-5-hydroxypyran-4-one Traditional Name: 2-[[(4-aminophenyl)thio]methyl]-5-hydroxy-pyran-4-one Formula: C12H11NO3S MolecularWeight: 249.28564

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1N)SCC2=CC(=O)C(=CO2)O

Isomeric SMILES

C1=CC(=CC=C1N)SCC2=CC(=O)C(=CO2)O

InChI

InChI=1S/C12H11NO3S/c13-8-1-3-10(4-2-8)17-7-9-5-11(14)12(15)6-16-9/h1-6,15H,7,13H2