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

Systemtic Name: 2-[(4-chlorophenyl)methylsulfanyl]-6-methyl-5-(phenylmethyl)-1H-pyrimidin-4-one Openeye Name: 5-benzyl-2-[(4-chlorophenyl)methylsulfanyl]-6-methyl-1H-pyrimidin-4-one CAS Name: 2-[(4-chlorophenyl)methylthio]-6-methyl-5-(phenylmethyl)-1H-pyrimidin-4-one IUPAC Name: 5-benzyl-2-[(4-chlorophenyl)methylsulfanyl]-6-methyl-1H-pyrimidin-4-one Traditional Name: 5-benzyl-2-[(4-chlorobenzyl)thio]-6-methyl-1H-pyrimidin-4-one Formula: C19H17ClN2OS MolecularWeight: 356.86908

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)SCC2=CC=C(C=C2)Cl)CC3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=O)N=C(N1)SCC2=CC=C(C=C2)Cl)CC3=CC=CC=C3

InChI

InChI=1S/C19H17ClN2OS/c1-13-17(11-14-5-3-2-4-6-14)18(23)22-19(21-13)24-12-15-7-9-16(20)10-8-15/h2-10H,11-12H2,1H3,(H,21,22,23)