5,6-dimethyl-2-(3-methylbutylsulfanyl)-1H-pyrimidin-4-one

Systemtic Name: 5,6-dimethyl-2-(3-methylbutylsulfanyl)-1H-pyrimidin-4-one Openeye Name: 2-isopentylsulfanyl-5,6-dimethyl-1H-pyrimidin-4-one CAS Name: 5,6-dimethyl-2-(3-methylbutylthio)-1H-pyrimidin-4-one IUPAC Name: 5,6-dimethyl-2-(3-methylbutylsulfanyl)-1H-pyrimidin-4-one Traditional Name: 2-(isoamylthio)-5,6-dimethyl-1H-pyrimidin-4-one Formula: C11H18N2OS MolecularWeight: 226.33842

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=NC1=O)SCCC(C)C)C

Isomeric SMILES

CC1=C(NC(=NC1=O)SCCC(C)C)C

InChI

InChI=1S/C11H18N2OS/c1-7(2)5-6-15-11-12-9(4)8(3)10(14)13-11/h7H,5-6H2,1-4H3,(H,12,13,14)