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

Systemtic Name: 6-phenyl-2-(phenylmethylsulfanyl)-5-propyl-1,3-diazinan-4-one Openeye Name: 2-benzylsulfanyl-6-phenyl-5-propyl-hexahydropyrimidin-4-one CAS Name: 6-phenyl-2-(phenylmethylthio)-5-propyl-1,3-diazinan-4-one IUPAC Name: 2-benzylsulfanyl-6-phenyl-5-propyl-1,3-diazinan-4-one Traditional Name: 2-(benzylthio)-6-phenyl-5-propyl-hexahydropyrimidin-4-one Formula: C20H24N2OS MolecularWeight: 340.48236

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1C(NC(NC1=O)SCC2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CCCC1C(NC(NC1=O)SCC2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C20H24N2OS/c1-2-9-17-18(16-12-7-4-8-13-16)21-20(22-19(17)23)24-14-15-10-5-3-6-11-15/h3-8,10-13,17-18,20-21H,2,9,14H2,1H3,(H,22,23)