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

Systemtic Name: 2-[(4-chlorophenyl)methylsulfanyl]-5-heptyl-6-phenyl-1,3-diazinan-4-one Openeye Name: 2-[(4-chlorophenyl)methylsulfanyl]-5-heptyl-6-phenyl-hexahydropyrimidin-4-one CAS Name: 2-[(4-chlorophenyl)methylthio]-5-heptyl-6-phenyl-1,3-diazinan-4-one IUPAC Name: 2-[(4-chlorophenyl)methylsulfanyl]-5-heptyl-6-phenyl-1,3-diazinan-4-one Traditional Name: 2-[(4-chlorobenzyl)thio]-5-heptyl-6-phenyl-hexahydropyrimidin-4-one Formula: C24H31ClN2OS MolecularWeight: 431.03374

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1C(NC(NC1=O)SCC2=CC=C(C=C2)Cl)C3=CC=CC=C3

Isomeric SMILES

CCCCCCCC1C(NC(NC1=O)SCC2=CC=C(C=C2)Cl)C3=CC=CC=C3

InChI

InChI=1S/C24H31ClN2OS/c1-2-3-4-5-9-12-21-22(19-10-7-6-8-11-19)26-24(27-23(21)28)29-17-18-13-15-20(25)16-14-18/h6-8,10-11,13-16,21-22,24,26H,2-5,9,12,17H2,1H3,(H,27,28)