5-butyl-4-oxidanyl-2-prop-2-ynylsulfanyl-1H-pyrimidin-6-one

Systemtic Name: 5-butyl-4-oxidanyl-2-prop-2-ynylsulfanyl-1H-pyrimidin-6-one Openeye Name: 5-butyl-4-hydroxy-2-prop-2-ynylsulfanyl-1H-pyrimidin-6-one CAS Name: 5-butyl-4-hydroxy-2-(prop-2-ynylthio)-1H-pyrimidin-6-one IUPAC Name: 5-butyl-4-hydroxy-2-prop-2-ynylsulfanyl-1H-pyrimidin-6-one Traditional Name: 5-butyl-4-hydroxy-2-(propargylthio)-1H-pyrimidin-6-one Formula: C11H14N2O2S MolecularWeight: 238.30606

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(N=C(NC1=O)SCC#C)O

Isomeric SMILES

CCCCC1=C(N=C(NC1=O)SCC#C)O

InChI

InChI=1S/C11H14N2O2S/c1-3-5-6-8-9(14)12-11(13-10(8)15)16-7-4-2/h2H,3,5-7H2,1H3,(H2,12,13,14,15)