5-ethyl-4-oxidanyl-2-phenacylsulfanyl-1H-pyrimidin-6-one

Systemtic Name: 5-ethyl-4-oxidanyl-2-phenacylsulfanyl-1H-pyrimidin-6-one Openeye Name: 5-ethyl-4-hydroxy-2-phenacylsulfanyl-1H-pyrimidin-6-one CAS Name: 5-ethyl-4-hydroxy-2-(phenacylthio)-1H-pyrimidin-6-one IUPAC Name: 5-ethyl-4-hydroxy-2-phenacylsulfanyl-1H-pyrimidin-6-one Traditional Name: 5-ethyl-4-hydroxy-2-(phenacylthio)-1H-pyrimidin-6-one Formula: C14H14N2O3S MolecularWeight: 290.33756

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N=C(NC1=O)SCC(=O)C2=CC=CC=C2)O

Isomeric SMILES

CCC1=C(N=C(NC1=O)SCC(=O)C2=CC=CC=C2)O

InChI

InChI=1S/C14H14N2O3S/c1-2-10-12(18)15-14(16-13(10)19)20-8-11(17)9-6-4-3-5-7-9/h3-7H,2,8H2,1H3,(H2,15,16,18,19)