6-methyl-5-[2-(2-methylpropylsulfinyl)ethyl]-2-(phenylmethyl)-1H-pyrimidin-4-one

Systemtic Name: 6-methyl-5-[2-(2-methylpropylsulfinyl)ethyl]-2-(phenylmethyl)-1H-pyrimidin-4-one Openeye Name: 2-benzyl-5-(2-isobutylsulfinylethyl)-6-methyl-1H-pyrimidin-4-one CAS Name: 6-methyl-5-[2-(2-methylpropylsulfinyl)ethyl]-2-(phenylmethyl)-1H-pyrimidin-4-one IUPAC Name: 2-benzyl-6-methyl-5-[2-(2-methylpropylsulfinyl)ethyl]-1H-pyrimidin-4-one Traditional Name: 2-benzyl-5-(2-isobutylsulfinylethyl)-6-methyl-1H-pyrimidin-4-one Formula: C18H24N2O2S MolecularWeight: 332.46036

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)CC2=CC=CC=C2)CCS(=O)CC(C)C

Isomeric SMILES

CC1=C(C(=O)N=C(N1)CC2=CC=CC=C2)CCS(=O)CC(C)C

InChI

InChI=1S/C18H24N2O2S/c1-13(2)12-23(22)10-9-16-14(3)19-17(20-18(16)21)11-15-7-5-4-6-8-15/h4-8,13H,9-12H2,1-3H3,(H,19,20,21)