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

Systemtic Name: 5-[2-[(4-methoxyphenyl)methylsulfanyl]ethyl]-6-methyl-2-propylsulfanyl-1,3-diazinan-4-one Openeye Name: 5-[2-[(4-methoxyphenyl)methylsulfanyl]ethyl]-6-methyl-2-propylsulfanyl-hexahydropyrimidin-4-one CAS Name: 5-[2-[(4-methoxyphenyl)methylthio]ethyl]-6-methyl-2-(propylthio)-1,3-diazinan-4-one IUPAC Name: 5-[2-[(4-methoxyphenyl)methylsulfanyl]ethyl]-6-methyl-2-propylsulfanyl-1,3-diazinan-4-one Traditional Name: 6-methyl-5-[2-(p-anisylthio)ethyl]-2-(propylthio)hexahydropyrimidin-4-one Formula: C18H28N2O2S2 MolecularWeight: 368.55712

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCSC1NC(C(C(=O)N1)CCSCC2=CC=C(C=C2)OC)C

Isomeric SMILES

CCCSC1NC(C(C(=O)N1)CCSCC2=CC=C(C=C2)OC)C

InChI

InChI=1S/C18H28N2O2S2/c1-4-10-24-18-19-13(2)16(17(21)20-18)9-11-23-12-14-5-7-15(22-3)8-6-14/h5-8,13,16,18-19H,4,9-12H2,1-3H3,(H,20,21)