2-(2-methylprop-2-enylsulfanyl)-6-phenyl-5-(phenylmethyl)-1,3-diazinan-4-one

Systemtic Name: 2-(2-methylprop-2-enylsulfanyl)-6-phenyl-5-(phenylmethyl)-1,3-diazinan-4-one Openeye Name: 5-benzyl-2-(2-methylallylsulfanyl)-6-phenyl-hexahydropyrimidin-4-one CAS Name: 2-(2-methylprop-2-enylthio)-6-phenyl-5-(phenylmethyl)-1,3-diazinan-4-one IUPAC Name: 5-benzyl-2-(2-methylprop-2-enylsulfanyl)-6-phenyl-1,3-diazinan-4-one Traditional Name: 5-benzyl-2-(2-methylallylthio)-6-phenyl-hexahydropyrimidin-4-one Formula: C21H24N2OS MolecularWeight: 352.49306

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=C)CSC1NC(C(C(=O)N1)CC2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CC(=C)CSC1NC(C(C(=O)N1)CC2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C21H24N2OS/c1-15(2)14-25-21-22-19(17-11-7-4-8-12-17)18(20(24)23-21)13-16-9-5-3-6-10-16/h3-12,18-19,21-22H,1,13-14H2,2H3,(H,23,24)