5-butyl-2-butylsulfanyl-6-methyl-1H-pyrimidin-4-one

Systemtic Name: 5-butyl-2-butylsulfanyl-6-methyl-1H-pyrimidin-4-one Openeye Name: 5-butyl-2-butylsulfanyl-6-methyl-1H-pyrimidin-4-one CAS Name: 5-butyl-2-(butylthio)-6-methyl-1H-pyrimidin-4-one IUPAC Name: 5-butyl-2-butylsulfanyl-6-methyl-1H-pyrimidin-4-one Traditional Name: 5-butyl-2-(butylthio)-6-methyl-1H-pyrimidin-4-one Formula: C13H22N2OS MolecularWeight: 254.39158

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(NC(=NC1=O)SCCCC)C

Isomeric SMILES

CCCCC1=C(NC(=NC1=O)SCCCC)C

InChI

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