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

Systemtic Name: 2-[(4-ethoxyphenyl)methylsulfanyl]-5-pentyl-6-phenyl-1,3-diazinan-4-one Openeye Name: 2-[(4-ethoxyphenyl)methylsulfanyl]-5-pentyl-6-phenyl-hexahydropyrimidin-4-one CAS Name: 2-[(4-ethoxyphenyl)methylthio]-5-pentyl-6-phenyl-1,3-diazinan-4-one IUPAC Name: 2-[(4-ethoxyphenyl)methylsulfanyl]-5-pentyl-6-phenyl-1,3-diazinan-4-one Traditional Name: 5-amyl-2-[(4-ethoxybenzyl)thio]-6-phenyl-hexahydropyrimidin-4-one Formula: C24H32N2O2S MolecularWeight: 412.58808

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1C(NC(NC1=O)SCC2=CC=C(C=C2)OCC)C3=CC=CC=C3

Isomeric SMILES

CCCCCC1C(NC(NC1=O)SCC2=CC=C(C=C2)OCC)C3=CC=CC=C3

InChI

InChI=1S/C24H32N2O2S/c1-3-5-7-12-21-22(19-10-8-6-9-11-19)25-24(26-23(21)27)29-17-18-13-15-20(16-14-18)28-4-2/h6,8-11,13-16,21-22,24-25H,3-5,7,12,17H2,1-2H3,(H,26,27)