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

Systemtic Name: 5-[2-[(4-methoxyphenyl)methylsulfanyl]ethyl]-6-methyl-2-pentylsulfanyl-1,3-diazinan-4-one Openeye Name: 5-[2-[(4-methoxyphenyl)methylsulfanyl]ethyl]-6-methyl-2-pentylsulfanyl-hexahydropyrimidin-4-one CAS Name: 5-[2-[(4-methoxyphenyl)methylthio]ethyl]-6-methyl-2-(pentylthio)-1,3-diazinan-4-one IUPAC Name: 5-[2-[(4-methoxyphenyl)methylsulfanyl]ethyl]-6-methyl-2-pentylsulfanyl-1,3-diazinan-4-one Traditional Name: 2-(amylthio)-6-methyl-5-[2-(p-anisylthio)ethyl]hexahydropyrimidin-4-one Formula: C20H32N2O2S2 MolecularWeight: 396.61028

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H32N2O2S2/c1-4-5-6-12-26-20-21-15(2)18(19(23)22-20)11-13-25-14-16-7-9-17(24-3)10-8-16/h7-10,15,18,20-21H,4-6,11-14H2,1-3H3,(H,22,23)