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

Systemtic Name: 2-butylsulfanyl-5-[2-[(4-chlorophenyl)methylsulfanyl]ethyl]-6-methyl-1,3-diazinan-4-one Openeye Name: 2-butylsulfanyl-5-[2-[(4-chlorophenyl)methylsulfanyl]ethyl]-6-methyl-hexahydropyrimidin-4-one CAS Name: 2-(butylthio)-5-[2-[(4-chlorophenyl)methylthio]ethyl]-6-methyl-1,3-diazinan-4-one IUPAC Name: 2-butylsulfanyl-5-[2-[(4-chlorophenyl)methylsulfanyl]ethyl]-6-methyl-1,3-diazinan-4-one Traditional Name: 2-(butylthio)-5-[2-[(4-chlorobenzyl)thio]ethyl]-6-methyl-hexahydropyrimidin-4-one Formula: C18H27ClN2OS2 MolecularWeight: 387.00278

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H27ClN2OS2/c1-3-4-10-24-18-20-13(2)16(17(22)21-18)9-11-23-12-14-5-7-15(19)8-6-14/h5-8,13,16,18,20H,3-4,9-12H2,1-2H3,(H,21,22)