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

Systemtic Name: 2-butylsulfanyl-5-[2-[(2,5-dimethylphenyl)methylsulfanyl]ethyl]-6-methyl-1,3-diazinan-4-one Openeye Name: 2-butylsulfanyl-5-[2-[(2,5-dimethylphenyl)methylsulfanyl]ethyl]-6-methyl-hexahydropyrimidin-4-one CAS Name: 2-(butylthio)-5-[2-[(2,5-dimethylphenyl)methylthio]ethyl]-6-methyl-1,3-diazinan-4-one IUPAC Name: 2-butylsulfanyl-5-[2-[(2,5-dimethylphenyl)methylsulfanyl]ethyl]-6-methyl-1,3-diazinan-4-one Traditional Name: 2-(butylthio)-5-[2-[(2,5-dimethylbenzyl)thio]ethyl]-6-methyl-hexahydropyrimidin-4-one Formula: C20H32N2OS2 MolecularWeight: 380.61088

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1NC(C(C(=O)N1)CCSCC2=C(C=CC(=C2)C)C)C

Isomeric SMILES

CCCCSC1NC(C(C(=O)N1)CCSCC2=C(C=CC(=C2)C)C)C

InChI

InChI=1S/C20H32N2OS2/c1-5-6-10-25-20-21-16(4)18(19(23)22-20)9-11-24-13-17-12-14(2)7-8-15(17)3/h7-8,12,16,18,20-21H,5-6,9-11,13H2,1-4H3,(H,22,23)