5-[(4-chlorophenyl)methyl]-2-methylsulfanyl-1H-pyrimidin-6-one

Systemtic Name: 5-[(4-chlorophenyl)methyl]-2-methylsulfanyl-1H-pyrimidin-6-one Openeye Name: 5-[(4-chlorophenyl)methyl]-2-methylsulfanyl-1H-pyrimidin-6-one CAS Name: 5-[(4-chlorophenyl)methyl]-2-(methylthio)-1H-pyrimidin-6-one IUPAC Name: 5-[(4-chlorophenyl)methyl]-2-methylsulfanyl-1H-pyrimidin-6-one Traditional Name: 5-(4-chlorobenzyl)-2-(methylthio)-1H-pyrimidin-6-one Formula: C12H11ClN2OS MolecularWeight: 266.74654

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H11ClN2OS/c1-17-12-14-7-9(11(16)15-12)6-8-2-4-10(13)5-3-8/h2-5,7H,6H2,1H3,(H,14,15,16)