6-methyl-5-(2-pentylsulfinylethyl)-2-(phenylmethyl)-1H-pyrimidin-4-one

Systemtic Name: 6-methyl-5-(2-pentylsulfinylethyl)-2-(phenylmethyl)-1H-pyrimidin-4-one Openeye Name: 2-benzyl-6-methyl-5-(2-pentylsulfinylethyl)-1H-pyrimidin-4-one CAS Name: 6-methyl-5-(2-pentylsulfinylethyl)-2-(phenylmethyl)-1H-pyrimidin-4-one IUPAC Name: 2-benzyl-6-methyl-5-(2-pentylsulfinylethyl)-1H-pyrimidin-4-one Traditional Name: 5-(2-amylsulfinylethyl)-2-benzyl-6-methyl-1H-pyrimidin-4-one Formula: C19H26N2O2S MolecularWeight: 346.48694

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCS(=O)CCC1=C(NC(=NC1=O)CC2=CC=CC=C2)C

Isomeric SMILES

CCCCCS(=O)CCC1=C(NC(=NC1=O)CC2=CC=CC=C2)C

InChI

InChI=1S/C19H26N2O2S/c1-3-4-8-12-24(23)13-11-17-15(2)20-18(21-19(17)22)14-16-9-6-5-7-10-16/h5-7,9-10H,3-4,8,11-14H2,1-2H3,(H,20,21,22)