2-decylsulfanyl-6-oxidanyl-1-phenyl-pyrimidin-4-one

Systemtic Name: 2-decylsulfanyl-6-oxidanyl-1-phenyl-pyrimidin-4-one Openeye Name: 2-decylsulfanyl-6-hydroxy-1-phenyl-pyrimidin-4-one CAS Name: 2-(decylthio)-6-hydroxy-1-phenyl-4-pyrimidinone IUPAC Name: 2-decylsulfanyl-6-hydroxy-1-phenylpyrimidin-4-one Traditional Name: 2-(decylthio)-6-hydroxy-1-phenyl-pyrimidin-4-one Formula: C20H28N2O2S MolecularWeight: 360.51352

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCSC1=NC(=O)C=C(N1C2=CC=CC=C2)O

Isomeric SMILES

CCCCCCCCCCSC1=NC(=O)C=C(N1C2=CC=CC=C2)O

InChI

InChI=1S/C20H28N2O2S/c1-2-3-4-5-6-7-8-12-15-25-20-21-18(23)16-19(24)22(20)17-13-10-9-11-14-17/h9-11,13-14,16,24H,2-8,12,15H2,1H3