2-methylsulfanyl-6-(phenylmethyl)-1H-pyrimidin-4-one

Systemtic Name: 2-methylsulfanyl-6-(phenylmethyl)-1H-pyrimidin-4-one Openeye Name: 6-benzyl-2-methylsulfanyl-1H-pyrimidin-4-one CAS Name: 2-(methylthio)-6-(phenylmethyl)-1H-pyrimidin-4-one IUPAC Name: 6-benzyl-2-methylsulfanyl-1H-pyrimidin-4-one Traditional Name: 6-benzyl-2-(methylthio)-1H-pyrimidin-4-one Formula: C12H12N2OS MolecularWeight: 232.30148

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC(=O)C=C(N1)CC2=CC=CC=C2

Isomeric SMILES

CSC1=NC(=O)C=C(N1)CC2=CC=CC=C2

InChI

InChI=1S/C12H12N2OS/c1-16-12-13-10(8-11(15)14-12)7-9-5-3-2-4-6-9/h2-6,8H,7H2,1H3,(H,13,14,15)