2-[(2-chlorophenyl)methylsulfanyl]-3-[(2,4-dichlorophenyl)methyl]-6-phenyl-pyrimidin-4-one

Systemtic Name: 2-[(2-chlorophenyl)methylsulfanyl]-3-[(2,4-dichlorophenyl)methyl]-6-phenyl-pyrimidin-4-one Openeye Name: 2-[(2-chlorophenyl)methylsulfanyl]-3-[(2,4-dichlorophenyl)methyl]-6-phenyl-pyrimidin-4-one CAS Name: 2-[(2-chlorophenyl)methylthio]-3-[(2,4-dichlorophenyl)methyl]-6-phenyl-4-pyrimidinone IUPAC Name: 2-[(2-chlorophenyl)methylsulfanyl]-3-[(2,4-dichlorophenyl)methyl]-6-phenylpyrimidin-4-one Traditional Name: 2-[(2-chlorobenzyl)thio]-3-(2,4-dichlorobenzyl)-6-phenyl-pyrimidin-4-one Formula: C24H17Cl3N2OS MolecularWeight: 487.82858

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=O)N(C(=N2)SCC3=CC=CC=C3Cl)CC4=C(C=C(C=C4)Cl)Cl

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=O)N(C(=N2)SCC3=CC=CC=C3Cl)CC4=C(C=C(C=C4)Cl)Cl

InChI

InChI=1S/C24H17Cl3N2OS/c25-19-11-10-17(21(27)12-19)14-29-23(30)13-22(16-6-2-1-3-7-16)28-24(29)31-15-18-8-4-5-9-20(18)26/h1-13H,14-15H2