6-azanyl-1-(4-chlorophenyl)-2-[(2,4-dichlorophenyl)methylsulfanyl]pyrimidin-4-one

Systemtic Name: 6-azanyl-1-(4-chlorophenyl)-2-[(2,4-dichlorophenyl)methylsulfanyl]pyrimidin-4-one Openeye Name: 6-amino-1-(4-chlorophenyl)-2-[(2,4-dichlorophenyl)methylsulfanyl]pyrimidin-4-one CAS Name: 6-amino-1-(4-chlorophenyl)-2-[(2,4-dichlorophenyl)methylthio]-4-pyrimidinone IUPAC Name: 6-amino-1-(4-chlorophenyl)-2-[(2,4-dichlorophenyl)methylsulfanyl]pyrimidin-4-one Traditional Name: 6-amino-1-(4-chlorophenyl)-2-[(2,4-dichlorobenzyl)thio]pyrimidin-4-one Formula: C17H12Cl3N3OS MolecularWeight: 412.72068

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1N2C(=CC(=O)N=C2SCC3=C(C=C(C=C3)Cl)Cl)N)Cl

Isomeric SMILES

C1=CC(=CC=C1N2C(=CC(=O)N=C2SCC3=C(C=C(C=C3)Cl)Cl)N)Cl

InChI

InChI=1S/C17H12Cl3N3OS/c18-11-3-5-13(6-4-11)23-15(21)8-16(24)22-17(23)25-9-10-1-2-12(19)7-14(10)20/h1-8H,9,21H2