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

Systemtic Name: 2-[(2-chlorophenyl)methylsulfanyl]-6-methyl-5-propyl-1H-pyrimidin-4-one Openeye Name: 2-[(2-chlorophenyl)methylsulfanyl]-6-methyl-5-propyl-1H-pyrimidin-4-one CAS Name: 2-[(2-chlorophenyl)methylthio]-6-methyl-5-propyl-1H-pyrimidin-4-one IUPAC Name: 2-[(2-chlorophenyl)methylsulfanyl]-6-methyl-5-propyl-1H-pyrimidin-4-one Traditional Name: 2-[(2-chlorobenzyl)thio]-6-methyl-5-propyl-1H-pyrimidin-4-one Formula: C15H17ClN2OS MolecularWeight: 308.82628

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(NC(=NC1=O)SCC2=CC=CC=C2Cl)C

Isomeric SMILES

CCCC1=C(NC(=NC1=O)SCC2=CC=CC=C2Cl)C

InChI

InChI=1S/C15H17ClN2OS/c1-3-6-12-10(2)17-15(18-14(12)19)20-9-11-7-4-5-8-13(11)16/h4-5,7-8H,3,6,9H2,1-2H3,(H,17,18,19)