6-oxidanyl-5-[pyridin-4-yl(sulfanyl)methyl]-3,4-dihydro-2H-naphthalen-1-one

Systemtic Name: 6-oxidanyl-5-[pyridin-4-yl(sulfanyl)methyl]-3,4-dihydro-2H-naphthalen-1-one Openeye Name: 6-hydroxy-5-[4-pyridyl(sulfanyl)methyl]tetralin-1-one CAS Name: 6-hydroxy-5-[mercapto(pyridin-4-yl)methyl]-3,4-dihydro-2H-naphthalen-1-one IUPAC Name: 6-hydroxy-5-[pyridin-4-yl(sulfanyl)methyl]-3,4-dihydro-2H-naphthalen-1-one Traditional Name: 6-hydroxy-5-[mercapto(4-pyridyl)methyl]tetralin-1-one Formula: C16H15NO2S MolecularWeight: 285.3608

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=CC(=C2C(C3=CC=NC=C3)S)O)C(=O)C1

Isomeric SMILES

C1CC2=C(C=CC(=C2C(C3=CC=NC=C3)S)O)C(=O)C1

InChI

InChI=1S/C16H15NO2S/c18-13-3-1-2-12-11(13)4-5-14(19)15(12)16(20)10-6-8-17-9-7-10/h4-9,16,19-20H,1-3H2