1-[(4-chloranylcyclohexyl)methyl]-4-methylsulfanyl-pyrimidin-2-one

Systemtic Name: 1-[(4-chloranylcyclohexyl)methyl]-4-methylsulfanyl-pyrimidin-2-one Openeye Name: 1-[(4-chlorocyclohexyl)methyl]-4-methylsulfanyl-pyrimidin-2-one CAS Name: 1-[(4-chlorocyclohexyl)methyl]-4-(methylthio)-2-pyrimidinone IUPAC Name: 1-[(4-chlorocyclohexyl)methyl]-4-methylsulfanylpyrimidin-2-one Traditional Name: 1-[(4-chlorocyclohexyl)methyl]-4-(methylthio)pyrimidin-2-one Formula: C12H17ClN2OS MolecularWeight: 272.79418

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC(=O)N(C=C1)CC2CCC(CC2)Cl

Isomeric SMILES

CSC1=NC(=O)N(C=C1)CC2CCC(CC2)Cl

InChI

InChI=1S/C12H17ClN2OS/c1-17-11-6-7-15(12(16)14-11)8-9-2-4-10(13)5-3-9/h6-7,9-10H,2-5,8H2,1H3