5-butyl-6-methyl-2-(propan-2-ylsulfonylmethyl)-1H-pyrimidin-4-one

Systemtic Name: 5-butyl-6-methyl-2-(propan-2-ylsulfonylmethyl)-1H-pyrimidin-4-one Openeye Name: 5-butyl-2-(isopropylsulfonylmethyl)-6-methyl-1H-pyrimidin-4-one CAS Name: 5-butyl-6-methyl-2-(propan-2-ylsulfonylmethyl)-1H-pyrimidin-4-one IUPAC Name: 5-butyl-6-methyl-2-(propan-2-ylsulfonylmethyl)-1H-pyrimidin-4-one Traditional Name: 5-butyl-2-(isopropylsulfonylmethyl)-6-methyl-1H-pyrimidin-4-one Formula: C13H22N2O3S MolecularWeight: 286.39038

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(NC(=NC1=O)CS(=O)(=O)C(C)C)C

Isomeric SMILES

CCCCC1=C(NC(=NC1=O)CS(=O)(=O)C(C)C)C

InChI

InChI=1S/C13H22N2O3S/c1-5-6-7-11-10(4)14-12(15-13(11)16)8-19(17,18)9(2)3/h9H,5-8H2,1-4H3,(H,14,15,16)