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5-heptyl-6-phenyl-2-(phenylmethylsulfanyl)-1,3-diazinan-4-one

5-heptyl-6-phenyl-2-(phenylmethylsulfanyl)-1,3-diazinan-4-one

Systemtic Name:5-heptyl-6-phenyl-2-(phenylmethylsulfanyl)-1,3-diazinan-4-one
Openeye Name:2-benzylsulfanyl-5-heptyl-6-phenyl-hexahydropyrimidin-4-one
CAS Name:5-heptyl-6-phenyl-2-(phenylmethylthio)-1,3-diazinan-4-one
IUPAC Name:2-benzylsulfanyl-5-heptyl-6-phenyl-1,3-diazinan-4-one
Traditional Name:2-(benzylthio)-5-heptyl-6-phenyl-hexahydropyrimidin-4-one
Formula: C24H32N2OS
MolecularWeight: 396.58868
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C24H32N2OS/c1-2-3-4-5-12-17-21-22(20-15-10-7-11-16-20)25-24(26-23(21)27)28-18-19-13-8-6-9-14-19/h6-11,13-16,21-22,24-25H,2-5,12,17-18H2,1H3,(H,26,27)


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