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

Systemtic Name: 6-[[2,6-bis(chloranyl)phenyl]methyl]-2-[(4-chlorophenyl)methylsulfanyl]-5-methyl-1H-pyrimidin-4-one Openeye Name: 2-[(4-chlorophenyl)methylsulfanyl]-6-[(2,6-dichlorophenyl)methyl]-5-methyl-1H-pyrimidin-4-one CAS Name: 2-[(4-chlorophenyl)methylthio]-6-[(2,6-dichlorophenyl)methyl]-5-methyl-1H-pyrimidin-4-one IUPAC Name: 2-[(4-chlorophenyl)methylsulfanyl]-6-[(2,6-dichlorophenyl)methyl]-5-methyl-1H-pyrimidin-4-one Traditional Name: 2-[(4-chlorobenzyl)thio]-6-(2,6-dichlorobenzyl)-5-methyl-1H-pyrimidin-4-one Formula: C19H15Cl3N2OS MolecularWeight: 425.7592

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=NC1=O)SCC2=CC=C(C=C2)Cl)CC3=C(C=CC=C3Cl)Cl

Isomeric SMILES

CC1=C(NC(=NC1=O)SCC2=CC=C(C=C2)Cl)CC3=C(C=CC=C3Cl)Cl

InChI

InChI=1S/C19H15Cl3N2OS/c1-11-17(9-14-15(21)3-2-4-16(14)22)23-19(24-18(11)25)26-10-12-5-7-13(20)8-6-12/h2-8H,9-10H2,1H3,(H,23,24,25)