5-(2-methylprop-2-enyl)-2-pentylsulfanyl-6-phenyl-1,3-diazinan-4-one

Systemtic Name: 5-(2-methylprop-2-enyl)-2-pentylsulfanyl-6-phenyl-1,3-diazinan-4-one Openeye Name: 5-(2-methylallyl)-2-pentylsulfanyl-6-phenyl-hexahydropyrimidin-4-one CAS Name: 5-(2-methylprop-2-enyl)-2-(pentylthio)-6-phenyl-1,3-diazinan-4-one IUPAC Name: 5-(2-methylprop-2-enyl)-2-pentylsulfanyl-6-phenyl-1,3-diazinan-4-one Traditional Name: 2-(amylthio)-5-(2-methylallyl)-6-phenyl-hexahydropyrimidin-4-one Formula: C19H28N2OS MolecularWeight: 332.50342

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCSC1NC(C(C(=O)N1)CC(=C)C)C2=CC=CC=C2

Isomeric SMILES

CCCCCSC1NC(C(C(=O)N1)CC(=C)C)C2=CC=CC=C2

InChI

InChI=1S/C19H28N2OS/c1-4-5-9-12-23-19-20-17(15-10-7-6-8-11-15)16(13-14(2)3)18(22)21-19/h6-8,10-11,16-17,19-20H,2,4-5,9,12-13H2,1,3H3,(H,21,22)