6-methyl-2-(3-methylbutylsulfanyl)-5-pentyl-1H-pyrimidin-4-one

Systemtic Name: 6-methyl-2-(3-methylbutylsulfanyl)-5-pentyl-1H-pyrimidin-4-one Openeye Name: 2-isopentylsulfanyl-6-methyl-5-pentyl-1H-pyrimidin-4-one CAS Name: 6-methyl-2-(3-methylbutylthio)-5-pentyl-1H-pyrimidin-4-one IUPAC Name: 6-methyl-2-(3-methylbutylsulfanyl)-5-pentyl-1H-pyrimidin-4-one Traditional Name: 5-amyl-2-(isoamylthio)-6-methyl-1H-pyrimidin-4-one Formula: C15H26N2OS MolecularWeight: 282.44474

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H26N2OS/c1-5-6-7-8-13-12(4)16-15(17-14(13)18)19-10-9-11(2)3/h11H,5-10H2,1-4H3,(H,16,17,18)