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

Systemtic Name: 5-[2-[(2,4-dimethylphenyl)methylsulfanyl]ethyl]-6-methyl-2-pentylsulfanyl-1,3-diazinan-4-one Openeye Name: 5-[2-[(2,4-dimethylphenyl)methylsulfanyl]ethyl]-6-methyl-2-pentylsulfanyl-hexahydropyrimidin-4-one CAS Name: 5-[2-[(2,4-dimethylphenyl)methylthio]ethyl]-6-methyl-2-(pentylthio)-1,3-diazinan-4-one IUPAC Name: 5-[2-[(2,4-dimethylphenyl)methylsulfanyl]ethyl]-6-methyl-2-pentylsulfanyl-1,3-diazinan-4-one Traditional Name: 2-(amylthio)-5-[2-[(2,4-dimethylbenzyl)thio]ethyl]-6-methyl-hexahydropyrimidin-4-one Formula: C21H34N2OS2 MolecularWeight: 394.63746

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCSC1NC(C(C(=O)N1)CCSCC2=C(C=C(C=C2)C)C)C

Isomeric SMILES

CCCCCSC1NC(C(C(=O)N1)CCSCC2=C(C=C(C=C2)C)C)C

InChI

InChI=1S/C21H34N2OS2/c1-5-6-7-11-26-21-22-17(4)19(20(24)23-21)10-12-25-14-18-9-8-15(2)13-16(18)3/h8-9,13,17,19,21-22H,5-7,10-12,14H2,1-4H3,(H,23,24)