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

Systemtic Name: 2-[(2-chlorophenyl)methylsulfanyl]-5-heptyl-6-phenyl-1,3-diazinan-4-one Openeye Name: 2-[(2-chlorophenyl)methylsulfanyl]-5-heptyl-6-phenyl-hexahydropyrimidin-4-one CAS Name: 2-[(2-chlorophenyl)methylthio]-5-heptyl-6-phenyl-1,3-diazinan-4-one IUPAC Name: 2-[(2-chlorophenyl)methylsulfanyl]-5-heptyl-6-phenyl-1,3-diazinan-4-one Traditional Name: 2-[(2-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=CC=C2Cl)C3=CC=CC=C3

Isomeric SMILES

CCCCCCCC1C(NC(NC1=O)SCC2=CC=CC=C2Cl)C3=CC=CC=C3

InChI

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