5-methyl-2-(3-methylbutylsulfanyl)-6-phenyl-1,3-diazinan-4-one

Systemtic Name: 5-methyl-2-(3-methylbutylsulfanyl)-6-phenyl-1,3-diazinan-4-one Openeye Name: 2-isopentylsulfanyl-5-methyl-6-phenyl-hexahydropyrimidin-4-one CAS Name: 5-methyl-2-(3-methylbutylthio)-6-phenyl-1,3-diazinan-4-one IUPAC Name: 5-methyl-2-(3-methylbutylsulfanyl)-6-phenyl-1,3-diazinan-4-one Traditional Name: 2-(isoamylthio)-5-methyl-6-phenyl-hexahydropyrimidin-4-one Formula: C16H24N2OS MolecularWeight: 292.43956

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(NC(NC1=O)SCCC(C)C)C2=CC=CC=C2

Isomeric SMILES

CC1C(NC(NC1=O)SCCC(C)C)C2=CC=CC=C2

InChI

InChI=1S/C16H24N2OS/c1-11(2)9-10-20-16-17-14(12(3)15(19)18-16)13-7-5-4-6-8-13/h4-8,11-12,14,16-17H,9-10H2,1-3H3,(H,18,19)