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

Systemtic Name: 5-(2-methylprop-2-enyl)-6-phenyl-2-(phenylmethylsulfanyl)-1,3-diazinan-4-one Openeye Name: 2-benzylsulfanyl-5-(2-methylallyl)-6-phenyl-hexahydropyrimidin-4-one CAS Name: 5-(2-methylprop-2-enyl)-6-phenyl-2-(phenylmethylthio)-1,3-diazinan-4-one IUPAC Name: 2-benzylsulfanyl-5-(2-methylprop-2-enyl)-6-phenyl-1,3-diazinan-4-one Traditional Name: 2-(benzylthio)-5-(2-methylallyl)-6-phenyl-hexahydropyrimidin-4-one Formula: C21H24N2OS MolecularWeight: 352.49306

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)CC1C(NC(NC1=O)SCC2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CC(=C)CC1C(NC(NC1=O)SCC2=CC=CC=C2)C3=CC=CC=C3

InChI

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