6-methyl-5-pentyl-2-propylsulfanyl-1H-pyrimidin-4-one

Systemtic Name: 6-methyl-5-pentyl-2-propylsulfanyl-1H-pyrimidin-4-one Openeye Name: 6-methyl-5-pentyl-2-propylsulfanyl-1H-pyrimidin-4-one CAS Name: 6-methyl-5-pentyl-2-(propylthio)-1H-pyrimidin-4-one IUPAC Name: 6-methyl-5-pentyl-2-propylsulfanyl-1H-pyrimidin-4-one Traditional Name: 5-amyl-6-methyl-2-(propylthio)-1H-pyrimidin-4-one Formula: C13H22N2OS MolecularWeight: 254.39158

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=C(NC(=NC1=O)SCCC)C

Isomeric SMILES

CCCCCC1=C(NC(=NC1=O)SCCC)C

InChI

InChI=1S/C13H22N2OS/c1-4-6-7-8-11-10(3)14-13(15-12(11)16)17-9-5-2/h4-9H2,1-3H3,(H,14,15,16)