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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=O)N=C(N1)SC

Isomeric SMILES

CC(C)(C)C1=CC(=O)N=C(N1)SC

InChI

InChI=1S/C9H14N2OS/c1-9(2,3)6-5-7(12)11-8(10-6)13-4/h5H,1-4H3,(H,10,11,12)