6-methyl-5-[2-(3-methylbutylsulfinyl)ethyl]-1H-pyrimidin-4-one

Systemtic Name: 6-methyl-5-[2-(3-methylbutylsulfinyl)ethyl]-1H-pyrimidin-4-one Openeye Name: 5-(2-isopentylsulfinylethyl)-6-methyl-1H-pyrimidin-4-one CAS Name: 6-methyl-5-[2-(3-methylbutylsulfinyl)ethyl]-1H-pyrimidin-4-one IUPAC Name: 6-methyl-5-[2-(3-methylbutylsulfinyl)ethyl]-1H-pyrimidin-4-one Traditional Name: 5-(2-isoamylsulfinylethyl)-6-methyl-1H-pyrimidin-4-one Formula: C12H20N2O2S MolecularWeight: 256.3644

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=CN1)CCS(=O)CCC(C)C

Isomeric SMILES

CC1=C(C(=O)N=CN1)CCS(=O)CCC(C)C

InChI

InChI=1S/C12H20N2O2S/c1-9(2)4-6-17(16)7-5-11-10(3)13-8-14-12(11)15/h8-9H,4-7H2,1-3H3,(H,13,14,15)