6-butyl-2-methylsulfanyl-1H-pyrimidin-4-one

Systemtic Name: 6-butyl-2-methylsulfanyl-1H-pyrimidin-4-one Openeye Name: 6-butyl-2-methylsulfanyl-1H-pyrimidin-4-one CAS Name: 6-butyl-2-(methylthio)-1H-pyrimidin-4-one IUPAC Name: 6-butyl-2-methylsulfanyl-1H-pyrimidin-4-one Traditional Name: 6-butyl-2-(methylthio)-1H-pyrimidin-4-one Formula: C9H14N2OS MolecularWeight: 198.28526

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=O)N=C(N1)SC

Isomeric SMILES

CCCCC1=CC(=O)N=C(N1)SC

InChI

InChI=1S/C9H14N2OS/c1-3-4-5-7-6-8(12)11-9(10-7)13-2/h6H,3-5H2,1-2H3,(H,10,11,12)