2-[(4-chlorophenyl)methylsulfanyl]-6-phenyl-5-(phenylmethyl)-1,3-diazinan-4-one

Systemtic Name: 2-[(4-chlorophenyl)methylsulfanyl]-6-phenyl-5-(phenylmethyl)-1,3-diazinan-4-one Openeye Name: 5-benzyl-2-[(4-chlorophenyl)methylsulfanyl]-6-phenyl-hexahydropyrimidin-4-one CAS Name: 2-[(4-chlorophenyl)methylthio]-6-phenyl-5-(phenylmethyl)-1,3-diazinan-4-one IUPAC Name: 5-benzyl-2-[(4-chlorophenyl)methylsulfanyl]-6-phenyl-1,3-diazinan-4-one Traditional Name: 5-benzyl-2-[(4-chlorobenzyl)thio]-6-phenyl-hexahydropyrimidin-4-one Formula: C24H23ClN2OS MolecularWeight: 422.97022

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2C(NC(NC2=O)SCC3=CC=C(C=C3)Cl)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CC2C(NC(NC2=O)SCC3=CC=C(C=C3)Cl)C4=CC=CC=C4

InChI

InChI=1S/C24H23ClN2OS/c25-20-13-11-18(12-14-20)16-29-24-26-22(19-9-5-2-6-10-19)21(23(28)27-24)15-17-7-3-1-4-8-17/h1-14,21-22,24,26H,15-16H2,(H,27,28)