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

Systemtic Name: 5-ethyl-6-methyl-2-phenacylsulfanyl-1H-pyrimidin-4-one Openeye Name: 5-ethyl-6-methyl-2-phenacylsulfanyl-1H-pyrimidin-4-one CAS Name: 5-ethyl-6-methyl-2-(phenacylthio)-1H-pyrimidin-4-one IUPAC Name: 5-ethyl-6-methyl-2-phenacylsulfanyl-1H-pyrimidin-4-one Traditional Name: 5-ethyl-6-methyl-2-(phenacylthio)-1H-pyrimidin-4-one Formula: C15H16N2O2S MolecularWeight: 288.36474

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H16N2O2S/c1-3-12-10(2)16-15(17-14(12)19)20-9-13(18)11-7-5-4-6-8-11/h4-8H,3,9H2,1-2H3,(H,16,17,19)