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

Systemtic Name: 2-butylsulfanyl-5-(2-methylprop-2-enyl)-6-phenyl-1,3-diazinan-4-one Openeye Name: 2-butylsulfanyl-5-(2-methylallyl)-6-phenyl-hexahydropyrimidin-4-one CAS Name: 2-(butylthio)-5-(2-methylprop-2-enyl)-6-phenyl-1,3-diazinan-4-one IUPAC Name: 2-butylsulfanyl-5-(2-methylprop-2-enyl)-6-phenyl-1,3-diazinan-4-one Traditional Name: 2-(butylthio)-5-(2-methylallyl)-6-phenyl-hexahydropyrimidin-4-one Formula: C18H26N2OS MolecularWeight: 318.47684

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1NC(C(C(=O)N1)CC(=C)C)C2=CC=CC=C2

Isomeric SMILES

CCCCSC1NC(C(C(=O)N1)CC(=C)C)C2=CC=CC=C2

InChI

InChI=1S/C18H26N2OS/c1-4-5-11-22-18-19-16(14-9-7-6-8-10-14)15(12-13(2)3)17(21)20-18/h6-10,15-16,18-19H,2,4-5,11-12H2,1,3H3,(H,20,21)