1-heptyl-6-methyl-2-methylsulfanyl-pyrimidin-4-one

Systemtic Name: 1-heptyl-6-methyl-2-methylsulfanyl-pyrimidin-4-one Openeye Name: 1-heptyl-6-methyl-2-methylsulfanyl-pyrimidin-4-one CAS Name: 1-heptyl-6-methyl-2-(methylthio)-4-pyrimidinone IUPAC Name: 1-heptyl-6-methyl-2-methylsulfanylpyrimidin-4-one Traditional Name: 1-heptyl-6-methyl-2-(methylthio)pyrimidin-4-one Formula: C13H22N2OS MolecularWeight: 254.39158

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCN1C(=CC(=O)N=C1SC)C

Isomeric SMILES

CCCCCCCN1C(=CC(=O)N=C1SC)C

InChI

InChI=1S/C13H22N2OS/c1-4-5-6-7-8-9-15-11(2)10-12(16)14-13(15)17-3/h10H,4-9H2,1-3H3