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

Systemtic Name: 2-butylsulfanyl-5-[2-[(4-ethoxyphenyl)methylsulfanyl]ethyl]-6-methyl-1,3-diazinan-4-one Openeye Name: 2-butylsulfanyl-5-[2-[(4-ethoxyphenyl)methylsulfanyl]ethyl]-6-methyl-hexahydropyrimidin-4-one CAS Name: 2-(butylthio)-5-[2-[(4-ethoxyphenyl)methylthio]ethyl]-6-methyl-1,3-diazinan-4-one IUPAC Name: 2-butylsulfanyl-5-[2-[(4-ethoxyphenyl)methylsulfanyl]ethyl]-6-methyl-1,3-diazinan-4-one Traditional Name: 2-(butylthio)-5-[2-[(4-ethoxybenzyl)thio]ethyl]-6-methyl-hexahydropyrimidin-4-one Formula: C20H32N2O2S2 MolecularWeight: 396.61028

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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