5-[2-[(2,5-dimethylphenyl)methylsulfanyl]ethyl]-6-oxidanyl-2-phenyl-1,3-diazinan-4-one

Systemtic Name: 5-[2-[(2,5-dimethylphenyl)methylsulfanyl]ethyl]-6-oxidanyl-2-phenyl-1,3-diazinan-4-one Openeye Name: 5-[2-[(2,5-dimethylphenyl)methylsulfanyl]ethyl]-6-hydroxy-2-phenyl-hexahydropyrimidin-4-one CAS Name: 5-[2-[(2,5-dimethylphenyl)methylthio]ethyl]-6-hydroxy-2-phenyl-1,3-diazinan-4-one IUPAC Name: 5-[2-[(2,5-dimethylphenyl)methylsulfanyl]ethyl]-6-hydroxy-2-phenyl-1,3-diazinan-4-one Traditional Name: 5-[2-[(2,5-dimethylbenzyl)thio]ethyl]-6-hydroxy-2-phenyl-hexahydropyrimidin-4-one Formula: C21H26N2O2S MolecularWeight: 370.50834

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)CSCCC2C(NC(NC2=O)C3=CC=CC=C3)O

Isomeric SMILES

CC1=CC(=C(C=C1)C)CSCCC2C(NC(NC2=O)C3=CC=CC=C3)O

InChI

InChI=1S/C21H26N2O2S/c1-14-8-9-15(2)17(12-14)13-26-11-10-18-20(24)22-19(23-21(18)25)16-6-4-3-5-7-16/h3-9,12,18-20,22,24H,10-11,13H2,1-2H3,(H,23,25)